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Presatovir - 98％, high purity , CAS No.1353625-73-6, Fusion glycoprotein F0 inhibitor

COA COA
    Grade & Purity:
  • ≥98%
In stock
Item Number
P412601
Grouped product items
SKU Size
Availability
 Price Qty
P412601-1mg
1mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$89.90
P412601-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$249.90
P412601-10mg
10mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$363.90
Wish List
Bulk Order  SDS  DATASHEET  Specification Sheet
View related series
Anti-infection (2803) RSV (40) Virus (1811)

Basic Description

Synonyms GS 5806 | C72410 | SCHEMBL2738142 | AS-56181 | AC-36927 | UNII-9628AJ27JA | Presatovir (USAN/INN) | EX-A4885 | N-[2-[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carbonyl]-4-chlorophenyl]methanesulfonamide | G
Specifications & Purity ≥98%
Biochemical and Physiological Mechanisms Presatovir (GS-5806) is a novel, orally bioavailable inhibitor of RSV fusion with EC50 of 0.43 nM.
Storage Temp Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type INHIBITOR
Mechanism of action Fusion glycoprotein F0 inhibitor
Product Description

Information

Presatovir (GS-5806) is a novel, orally bioavailable inhibitor of RSV fusion with EC50 of 0.43 nM.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Benzenoids
Class Benzene and substituted derivatives
Subclass Benzoyl derivatives
Intermediate Tree Nodes Not available
Direct Parent 1-benzoylpiperidines
Alternative Parents N-benzoylpiperidines  3-halobenzoic acids and derivatives  Sulfanilides  Benzamides  Pyrazolo[1,5-a]pyrimidines  Dialkylarylamines  Aminopyrimidines and derivatives  Chlorobenzenes  Aryl chlorides  Organosulfonamides  Imidolactams  Organic sulfonamides  Tertiary carboxylic acid amides  Heteroaromatic compounds  Pyrazoles  Pyrrolidines  Vinylogous amides  Aminosulfonyl compounds  Amino acids and derivatives  Azacyclic compounds  Monoalkylamines  Hydrocarbon derivatives  Organooxygen compounds  Organic oxides  Organochlorides  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents N-benzoylpiperidine - 1-benzoylpiperidine - Sulfanilide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Pyrazolo[1,5-a]pyrimidine - N-acyl-piperidine - Pyrazolopyrimidine - Dialkylarylamine - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Piperidine - Imidolactam - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Pyrrolidine - Heteroaromatic compound - Pyrazole - Azole - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Sulfonyl - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Primary amine - Amine - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as 1-benzoylpiperidines. These are compounds containing a piperidine ring substituted at the 1-position with a benzoyl group.
External Descriptors Not available

Product Properties

ALogP 2.4

Associated Targets(Human)

Homo sapiens (32628 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MT4 (17854 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Human orthopneumovirus (392 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Canis familiaris (36305 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Respiratory syncytial virus (3434 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Cynomolgus monkey (4946 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Plasma (328 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Lung (9 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
F Fusion glycoprotein F0 (242 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name N-[2-[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carbonyl]-4-chlorophenyl]methanesulfonamide
INCHI InChI=1S/C24H30ClN7O3S/c1-15-13-32-22(27-23(15)30-10-8-17(26)14-30)12-20(28-32)21-5-3-4-9-31(21)24(33)18-11-16(25)6-7-19(18)29-36(2,34)35/h6-7,11-13,17,21,29H,3-5,8-10,14,26H2,1-2H3/t17-,21-/m0/s1
InChIKey GOFXWTVKPWJNGD-UWJYYQICSA-N
Smiles CC1=CN2C(=CC(=N2)C3CCCCN3C(=O)C4=C(C=CC(=C4)Cl)NS(=O)(=O)C)N=C1N5CCC(C5)N
Isomeric SMILES CC1=CN2C(=CC(=N2)[C@@H]3CCCCN3C(=O)C4=C(C=CC(=C4)Cl)NS(=O)(=O)C)N=C1N5CC[C@@H](C5)N
PubChem CID 58029842
Molecular Weight 532.06

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 532.100 g/mol
XLogP3 2.400
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 531.182 Da
Monoisotopic Mass 531.182 Da
Topological Polar Surface Area 134.000 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 905.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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