那曲酮
TL;DR: 那曲酮 (CAS 16676-29-2) is a chemical compound with molecular formula C20H23NO4 and molecular weight 341.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
那曲酮
(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Also Known As: naltrexone, Vivitrol, Vivitrex, Celupan, ReVia
| Molecular Formula | C20H23NO4 |
|---|---|
| Molecular Weight | 341.16 g/mol |
| LogP | 1.5254 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.16272 |
| Heavy Atoms | 25 |
| Complexity | 803.13104 |
Chemical Identifiers
| CAS Number | 16676-29-2 |
|---|---|
| SMILES | C1CC1CN2CC[C@]34[C@@H]5C(=O)CC[C@]3([C@H]2CC6=C4C(=C(C=C6)O)O5)O |
Product Overview
那曲酮 (CAS 16676-29-2), with molecular formula C20H23NO4 and molecular weight 341.16 g/mol. IUPAC: (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one.
Chemical Property Profile of 那曲酮
Property Insights of 那曲酮
The XLogP value of 1.5254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 那曲酮. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 那曲酮. Following Lipinski's Rule of Five, 那曲酮 has 2 hydrogen bond donor(s) and 5 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 那曲酮?
The CAS number of 那曲酮 is 16676-29-2.
What is the molecular formula of 那曲酮?
The molecular formula of 那曲酮 is C20H23NO4.
What is the molecular weight of 那曲酮?
The molecular weight of 那曲酮 is 341.16 g/mol.
Where can I buy 那曲酮?
You can request a quote for 那曲酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 那曲酮?
Yes, KEHONG BIO provides custom synthesis services for 那曲酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.