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Velufenacin

CAT: 0804-HY-109196-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-109196-01Size:5 mg
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Description
Velufenacin is a muscarinic receptor antagonist[1].
CAS Number
1648737-78-3
Product Name Alternative
DA-8010
UNSPSC
12352005
Target
MAChR
Type
Reference compound
Related Pathways
GPCR/G Protein; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/velufenacin.html
Purity
99.12
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
O=C(OC[C@H]1CN(C)CC1)NC2=CC=CC=C2C3=CC=C(F)C(Cl)=C3
Molecular Formula
C19H20ClFN2O2
Molecular Weight
362.83
References & Citations
[1]International Nonproprietary Names for Pharmaceutical Substances (INN) . WHO Drug Information, Vol. 33, No. 4, 2019.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
Phase 3

Chemical Information

Velufenacin

Velufenacin is a small molecule drug. The usage of the INN stem '-fenacin' in the name indicates that Velufenacin is a muscarinic receptor antagonist. Velufenacin is under investigation in clinical trial NCT05282069 (A Study to Evaluate the Efficacy and Safety of DA-8010 in Patients With Overactive Bladder). Velufenacin has a monoisotopic molecular weight of 362.12 Da.

CAS Number1648737-78-3
PubChem CID121425461
IUPAC Name[(3R)-1-methylpyrrolidin-3-yl]methyl N-[2-(3-chloro-4-fluorophenyl)phenyl]carbamate
Molecular FormulaC19H20ClFN2O2
Molecular Weight362.8
XLogP4.3
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity453
SMILES
CN1CC[C@H](C1)COC(=O)NC2=CC=CC=C2C3=CC(=C(C=C3)F)Cl
InChI
InChI=1S/C19H20ClFN2O2/c1-23-9-8-13(11-23)12-25-19(24)22-18-5-3-2-4-15(18)14-6-7-17(21)16(20)10-14/h2-7,10,13H,8-9,11-12H2,1H3,(H,22,24)/t13-/m1/s1
InChIKey
SYBGVVSJNMTWCI-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of Velufenacin
CAS: 1648737-78-3
CID: 121425461
Formula: C19H20ClFN2O2
MW: 362.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight362.8
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass362.1197337
Monoisotopic Mass362.1197337
Topological Polar Surface Area41.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity453
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
BA5533-10Velufenacin

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