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Besifovir - 10mM in DMSO, high purity , CAS No.441785-25-7

    Grade & Purity:
  • 10mM in DMSO
In stock
Item Number
B423990
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Availability
Price Qty
B423990-1ml
1ml
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$410.90

HBV Inhibitors

View related series
Compound libraries (12325)

Basic Description

Synonyms Besifovir | 441785-25-7 | ((1-((2-Amino-9H-purin-9-yl)methyl)cyclopropoxy)methyl)phosphonic acid | Besifovir [INN] | UNII-4PLG22CQUU | 4PLG22CQUU | [1-[(2-aminopurin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid | LB80331 | (((1-((2-Amino-9H-purin-9-yl)methyl)cyclopro
Specifications & Purity 10mM in DMSO
Biochemical and Physiological Mechanisms Besifovir is novel and potent acyclic nucleotide phosphonate used to treat hepatitis B virus (HBV) infection.
Storage Temp Store at -80°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description

Information

Besifovir Besifovir is novel and potent acyclic nucleotide phosphonate used to treat hepatitis B virus (HBV) infection.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Imidazopyrimidines
Subclass Purines and purine derivatives
Intermediate Tree Nodes Not available
Direct Parent Purines and purine derivatives
Alternative Parents Aminopyrimidines and derivatives  N-substituted imidazoles  Organic phosphonic acids  Heteroaromatic compounds  Azacyclic compounds  Primary amines  Organophosphorus compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents Purine - Aminopyrimidine - N-substituted imidazole - Pyrimidine - Azole - Imidazole - Organophosphonic acid - Organophosphonic acid derivative - Heteroaromatic compound - Azacycle - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Primary amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as purines and purine derivatives. These are aromatic heterocyclic compounds containing a purine moiety, which is formed a pyrimidine-ring ring fused to an imidazole ring.
External Descriptors Not available

Associated Targets(Human)

Homo sapiens (32628 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HepG2 (196354 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Liver (3974 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Rattus norvegicus (775804 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

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 [1-[(2-aminopurin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid
INCHI InChI=1S/C10H14N5O4P/c11-9-12-3-7-8(14-9)15(5-13-7)4-10(1-2-10)19-6-20(16,17)18/h3,5H,1-2,4,6H2,(H2,11,12,14)(H2,16,17,18)
InChIKey KDNSSKPZBDNJDF-UHFFFAOYSA-N
Smiles C1CC1(CN2C=NC3=CN=C(N=C32)N)OCP(=O)(O)O
Isomeric SMILES C1CC1(CN2C=NC3=CN=C(N=C32)N)OCP(=O)(O)O
Molecular Weight 299.23
Reaxy-Rn 9717556
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9717556&ln=

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

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

Chemical and Physical Properties

Molecular Weight 299.220 g/mol
XLogP3 -1.800
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 299.078 Da
Monoisotopic Mass 299.078 Da
Topological Polar Surface Area 136.000 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 414.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
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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