(5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol
TL;DR: (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol (CAS 466-94-4) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,5R,7aS,12bS)-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-5,9-diol
Also Known As: beta-Isomorphine, Pseudocodeine, EINECS 207-379-3, Morphinan-3,8-diol, 6,7-didehydro-4,5-epoxy-17-methyl-, (5-alpha,8-alpha)-, 6,7-Didehydro-4,5alpha-epoxy-17-methylmorphinan-3,8alpha-diol
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.14 g/mol |
| LogP | 1.1981 |
| Topological Polar Surface Area | 52.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 670.2442 |
Chemical Identifiers
| CAS Number | 466-94-4 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4C=C[C@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)O)O4)O |
Product Overview
(5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol (CAS 466-94-4), with molecular formula C17H19NO3 and molecular weight 285.14 g/mol. IUPAC: (4R,4aR,5R,7aS,12bS)-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-5,9-diol.
Chemical Property Profile of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol
Property Insights of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol
The XLogP value of 1.1981 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol. With a topological polar surface area (TPSA) of 52.93 Ų, (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol has 2 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 (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol?
The CAS number of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol is 466-94-4.
What is the molecular formula of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol?
The molecular formula of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol is C17H19NO3.
What is the molecular weight of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol?
The molecular weight of (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol is 285.14 g/mol.
Where can I buy (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol?
You can request a quote for (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol?
Yes, KEHONG BIO provides custom synthesis services for (5alpha,8alpha)-6,7-Didehydro-4,5-epoxy-17-methylmorphinan-3,8-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.