alpha-Descyclohexyl-alpha-phenyl oxybutynin
TL;DR: alpha-Descyclohexyl-alpha-phenyl oxybutynin (CAS 14943-53-4) is a chemical compound with molecular formula C22H25NO3 and molecular weight 351.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(diethylamino)but-2-ynyl 2-hydroxy-2,2-diphenylacetate
Also Known As: alpha-Descyclohexyl-alpha-phenyl Oxybutynin, Oxybutynin EP Impurity B, Oxybutynin Impurity B, Diphenyl analogue of oxybutynin, 4-(diethylamino)but-2-ynyl 2-hydroxy-2,2-diphenylacetate
| Molecular Formula | C22H25NO3 |
|---|---|
| Molecular Weight | 351.18 g/mol |
| LogP | 2.8109 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 351.18344 |
| Heavy Atoms | 26 |
| Complexity | 703.70685 |
Chemical Identifiers
| CAS Number | 14943-53-4 |
|---|---|
| SMILES | CCN(CC)CC#CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O |
Product Overview
alpha-Descyclohexyl-alpha-phenyl oxybutynin (CAS 14943-53-4), with molecular formula C22H25NO3 and molecular weight 351.18 g/mol. IUPAC: 4-(diethylamino)but-2-ynyl 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of alpha-Descyclohexyl-alpha-phenyl oxybutynin
Property Insights of alpha-Descyclohexyl-alpha-phenyl oxybutynin
The XLogP value of 2.8109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Descyclohexyl-alpha-phenyl oxybutynin. With a topological polar surface area (TPSA) of 49.77 Ų, alpha-Descyclohexyl-alpha-phenyl oxybutynin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Descyclohexyl-alpha-phenyl oxybutynin has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-Descyclohexyl-alpha-phenyl oxybutynin?
The CAS number of alpha-Descyclohexyl-alpha-phenyl oxybutynin is 14943-53-4.
What is the molecular formula of alpha-Descyclohexyl-alpha-phenyl oxybutynin?
The molecular formula of alpha-Descyclohexyl-alpha-phenyl oxybutynin is C22H25NO3.
What is the molecular weight of alpha-Descyclohexyl-alpha-phenyl oxybutynin?
The molecular weight of alpha-Descyclohexyl-alpha-phenyl oxybutynin is 351.18 g/mol.
Where can I buy alpha-Descyclohexyl-alpha-phenyl oxybutynin?
You can request a quote for alpha-Descyclohexyl-alpha-phenyl oxybutynin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Descyclohexyl-alpha-phenyl oxybutynin?
Yes, KEHONG BIO provides custom synthesis services for alpha-Descyclohexyl-alpha-phenyl oxybutynin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.