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mAChR
5-hydroxymethyl Tolterodine (PNU 200577, 5-HMT, 5-HM) - ≥99%, high purity , CAS No.207679-81-0

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5-hydroxymethyl Tolterodine (PNU 200577, 5-HMT, 5-HM) - ≥99%, high purity , CAS No.207679-81-0

COA

Grade & Purity:

≥99%

Cas Number: 207679-81-0
Molecular Weight: 341.49
PubChem CID: 9819382
PubChem SID: 504764907

In stock

Item Number

H129983

Grouped product items
SKU	Size	Availability	Price
H129983-1mg	1mg	3	$42.90
H129983-5mg	5mg	3	$177.90
H129983-10mg	10mg	3	$276.90
H129983-50mg	50mg	2	$692.90
H129983-100mg	100mg	3	$1,008.90
H129983-250mg	250mg	2	$2,270.90
H129983-500mg	500mg	2	$4,086.90

View related series

Class A GPCR (4138) GPCR/G Protein (3172) mAChR (182) Neuronal Signaling (3320)

Basic Description

Synonyms	Desfesoterodine \| NCGC00346585-01 \| (R)-2-(3-(Diisopropylamino)-1-phenylpropyl)-4-(hydroxymethyl)phenol \| AMY14591 \| Benzenemethanol, 3-((1R)-3-(bis(1-methylethyl)amino)-1-phenylpropyl)-4-hydroxy- \| HY-76569 \| (R)-2-[3-(Diisopropylamino)-1-phenylpropyl]-4
Specifications & Purity	≥99%
Biochemical and Physiological Mechanisms	(R)-5-Hydroxymethyl Tolterodine is a potent and selective muscarinic receptor antagonist with a Kb and a pA2 of 0.84 nM and 9.14, respectively. (R)-5-Hydroxymethyl Tolterodine is a major pharmacologically active metabolite of tolterodine.
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.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Diphenylmethanes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Benzyl alcohols Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Trialkylamines Primary alcohols Organopnictogen compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diphenylmethane - Benzyl alcohol - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Tertiary amine - Tertiary aliphatic amine - Amine - Alcohol - Primary alcohol - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic alcohol - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Pubchem Sid	504764907
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504764907
IUPAC Name	2-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-(hydroxymethyl)phenol
INCHI	InChI=1S/C22H31NO2/c1-16(2)23(17(3)4)13-12-20(19-8-6-5-7-9-19)21-14-18(15-24)10-11-22(21)25/h5-11,14,16-17,20,24-25H,12-13,15H2,1-4H3/t20-/m1/s1
InChIKey	DUXZAXCGJSBGDW-HXUWFJFHSA-N
Smiles	CC(C)N(CCC(C1=CC=CC=C1)C2=C(C=CC(=C2)CO)O)C(C)C
Isomeric SMILES	CC(C)N(CC[C@H](C1=CC=CC=C1)C2=C(C=CC(=C2)CO)O)C(C)C
Molecular Weight	341.49
Reaxy-Rn	13260616
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13260616&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

7 results found

Lot Number	Certificate Type	Date	Item
C2303670	Certificate of Analysis	Dec 05, 2024	H129983
C2303671	Certificate of Analysis	Dec 05, 2024	H129983
C2303663	Certificate of Analysis	Dec 05, 2024	H129983
C2303669	Certificate of Analysis	Dec 05, 2024	H129983
C2303667	Certificate of Analysis	Dec 05, 2024	H129983
C2303672	Certificate of Analysis	Dec 05, 2024	H129983
C2303658	Certificate of Analysis	Dec 05, 2024	H129983

Chemical and Physical Properties

Solubility	68 mg/mL in DMSO or Ethanol, insoluble in water
Molecular Weight	341.500 g/mol
XLogP3	4.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	8
Exact Mass	341.235 Da
Monoisotopic Mass	341.235 Da
Topological Polar Surface Area	43.700 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	357.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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

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