Naltrexone phenyl oxime
TL;DR: Naltrexone phenyl oxime (CAS 115160-07-1) is a chemical compound with molecular formula C26H28N2O4 and molecular weight 432.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aS,7Z,7aR,12bS)-3-(cyclopropylmethyl)-7-phenoxyimino-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol
Also Known As: Naltrexone phenyl oxime, Npc 168, (4R,4As,7Z,7aR,12bS)-3-(cyclopropylmethyl)-7-phenoxyimino-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol
| Molecular Formula | C26H28N2O4 |
|---|---|
| Molecular Weight | 432.20 g/mol |
| LogP | 3.3913 |
| Topological Polar Surface Area | 74.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.2049 |
| Heavy Atoms | 32 |
| Complexity | 1114.31 |
Chemical Identifiers
| CAS Number | 115160-07-1 |
|---|---|
| SMILES | C1CC1CN2CC[C@]34[C@@H]5/C(=N\OC6=CC=CC=C6)/CC[C@]3([C@H]2CC7=C4C(=C(C=C7)O)O5)O |
Product Overview
Naltrexone phenyl oxime (CAS 115160-07-1), with molecular formula C26H28N2O4 and molecular weight 432.20 g/mol. IUPAC: (4R,4aS,7Z,7aR,12bS)-3-(cyclopropylmethyl)-7-phenoxyimino-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol.
Chemical Property Profile of Naltrexone phenyl oxime
Property Insights of Naltrexone phenyl oxime
The XLogP value of 3.3913 indicates that Naltrexone phenyl oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Naltrexone phenyl oxime. Following Lipinski's Rule of Five, Naltrexone phenyl oxime has 2 hydrogen bond donor(s) and 6 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 Naltrexone phenyl oxime?
The CAS number of Naltrexone phenyl oxime is 115160-07-1.
What is the molecular formula of Naltrexone phenyl oxime?
The molecular formula of Naltrexone phenyl oxime is C26H28N2O4.
What is the molecular weight of Naltrexone phenyl oxime?
The molecular weight of Naltrexone phenyl oxime is 432.20 g/mol.
Where can I buy Naltrexone phenyl oxime?
You can request a quote for Naltrexone phenyl oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naltrexone phenyl oxime?
Yes, KEHONG BIO provides custom synthesis services for Naltrexone phenyl oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.