奥昔啡烷
TL;DR: 奥昔啡烷 (CAS 42281-59-4) is a chemical compound with molecular formula C20H27NO2 and molecular weight 313.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
奥昔啡烷
(1S,9R,10S)-17-(cyclopropylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol
Also Known As: Oxilorphan, Oxilorfano, Oxilorphane, Oxilorphanum, Oxylorphan
| Molecular Formula | C20H27NO2 |
|---|---|
| Molecular Weight | 313.20 g/mol |
| LogP | 2.9755 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.2042 |
| Heavy Atoms | 23 |
| Complexity | 640.5289 |
Chemical Identifiers
| CAS Number | 42281-59-4 |
|---|---|
| SMILES | C1CC[C@]2([C@H]3CC4=C([C@]2(C1)CCN3CC5CC5)C=C(C=C4)O)O |
Product Overview
奥昔啡烷 (CAS 42281-59-4), with molecular formula C20H27NO2 and molecular weight 313.20 g/mol. IUPAC: (1S,9R,10S)-17-(cyclopropylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol.
Chemical Property Profile of 奥昔啡烷
Property Insights of 奥昔啡烷
The XLogP value of 2.9755 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 奥昔啡烷. With a topological polar surface area (TPSA) of 43.7 Ų, 奥昔啡烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 奥昔啡烷 has 2 hydrogen bond donor(s) and 3 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 奥昔啡烷?
The CAS number of 奥昔啡烷 is 42281-59-4.
What is the molecular formula of 奥昔啡烷?
The molecular formula of 奥昔啡烷 is C20H27NO2.
What is the molecular weight of 奥昔啡烷?
The molecular weight of 奥昔啡烷 is 313.20 g/mol.
Where can I buy 奥昔啡烷?
You can request a quote for 奥昔啡烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 奥昔啡烷?
Yes, KEHONG BIO provides custom synthesis services for 奥昔啡烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.