酮啡诺
TL;DR: 酮啡诺 (CAS 79798-39-3) is a chemical compound with molecular formula C23H29NO3 and molecular weight 367.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
酮啡诺
(4aR,5S,7aR,12bS)-3-(cyclopropylmethyl)-5-ethyl-9-methoxy-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Also Known As: Ketorfanol, CONORFONE, CONORPHONE HYDROCHLORIDE, (trimethylsilylmethyl)dimethylchloromethylsilane
| Molecular Formula | C23H29NO3 |
|---|---|
| Molecular Weight | 367.21 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.21475 |
| Heavy Atoms | 27 |
| Complexity | 633.0 |
Chemical Identifiers
| CAS Number | 79798-39-3 |
|---|---|
| SMILES | CC[C@H]1CC(=O)[C@H]2[C@@]34[C@@H]1C(CC5=C3C(=C(C=C5)OC)O2)N(CC4)CC6CC6 |
| InChIKey | JMPUQJQXECRLKY-MNABOLNXSA-N |
Product Overview
酮啡诺 (CAS 79798-39-3), with molecular formula C23H29NO3 and molecular weight 367.21 g/mol. IUPAC: (4aR,5S,7aR,12bS)-3-(cyclopropylmethyl)-5-ethyl-9-methoxy-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one.
Chemical Property Profile of 酮啡诺
Property Insights of 酮啡诺
The XLogP value of 3.9 indicates that 酮啡诺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 酮啡诺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 酮啡诺 has 0 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 酮啡诺?
The CAS number of 酮啡诺 is 79798-39-3.
What is the molecular formula of 酮啡诺?
The molecular formula of 酮啡诺 is C23H29NO3.
What is the molecular weight of 酮啡诺?
The molecular weight of 酮啡诺 is 367.21 g/mol.
Where can I buy 酮啡诺?
You can request a quote for 酮啡诺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酮啡诺?
Yes, KEHONG BIO provides custom synthesis services for 酮啡诺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.