3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol
TL;DR: 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol (CAS 6474-98-2) is a chemical compound with molecular formula C25H29NO4 and molecular weight 407.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aS,7S,7aR,12bS)-9-methoxy-3-(2-phenylethyl)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,7-diol
Also Known As: 7,8-Dihydro-14-hydroxy-N-phenethylnorcodeine, Norcodeine, 7,8-dihydro-14-hydroxy-N-phenethyl-, 4,5-alpha-Epoxy-3-methoxy-17-phenethylmorphinan-6-alpha,14-diol, 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol, Morphinan-6-alpha,14-diol, 4,5-alpha-epoxy-3-methoxy-17-phenethyl-
| Molecular Formula | C25H29NO4 |
|---|---|
| Molecular Weight | 407.21 g/mol |
| LogP | 2.4529 |
| Topological Polar Surface Area | 62.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.20966 |
| Heavy Atoms | 30 |
| Complexity | 978.61395 |
Chemical Identifiers
| CAS Number | 6474-98-2 |
|---|---|
| SMILES | COC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4CCC6=CC=CC=C6)[C@@H](O2)[C@H](CC5)O)O)C=C1 |
Product Overview
3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol (CAS 6474-98-2), with molecular formula C25H29NO4 and molecular weight 407.21 g/mol. IUPAC: (4R,4aS,7S,7aR,12bS)-9-methoxy-3-(2-phenylethyl)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,7-diol.
Chemical Property Profile of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol
Property Insights of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol
The XLogP value of 2.4529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol. The TPSA of 62.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol. Following Lipinski's Rule of Five, 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol 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 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol?
The CAS number of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol is 6474-98-2.
What is the molecular formula of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol?
The molecular formula of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol is C25H29NO4.
What is the molecular weight of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol?
The molecular weight of 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol is 407.21 g/mol.
Where can I buy 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol?
You can request a quote for 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-17-(2-phenylethyl)-4,5-epoxymorphinan-6,14-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.