3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan
TL;DR: 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan (CAS 63690-29-9) is a chemical compound with molecular formula C23H23NO3 and molecular weight 361.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,5S,7aS,12bS)-9-methoxy-5-phenoxy-1,2,3,4,4a,5,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline
Also Known As: Pseudocodeine phenyl ether, 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan, Morphinan, 6,7-didehydro-4,5-alpha-epoxy-3-methoxy-8-beta-phenoxy-, 6,7-Didehydro-4,5alpha-epoxy-3-methoxy-8beta-phenoxymorphinan, 3-Methoxy-8beta-phenoxy-5alpha-6,7-didehydro-4,5-epoxymorphinan
| Molecular Formula | C23H23NO3 |
|---|---|
| Molecular Weight | 361.17 g/mol |
| LogP | 3.2456 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.1678 |
| Heavy Atoms | 27 |
| Complexity | 924.72076 |
Chemical Identifiers
| CAS Number | 63690-29-9 |
|---|---|
| SMILES | COC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4)[C@@H](O2)C=C[C@@H]5OC6=CC=CC=C6)C=C1 |
Product Overview
3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan (CAS 63690-29-9), with molecular formula C23H23NO3 and molecular weight 361.17 g/mol. IUPAC: (4R,4aR,5S,7aS,12bS)-9-methoxy-5-phenoxy-1,2,3,4,4a,5,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline.
Chemical Property Profile of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan
Property Insights of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan
The XLogP value of 3.2456 indicates that 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan 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 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan?
The CAS number of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan is 63690-29-9.
What is the molecular formula of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan?
The molecular formula of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan is C23H23NO3.
What is the molecular weight of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan?
The molecular weight of 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan is 361.17 g/mol.
Where can I buy 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan?
You can request a quote for 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-8-phenoxy-6,7-didehydro-4,5-epoxymorphinan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.