Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-
TL;DR: Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- (CAS 42123-08-0) is a chemical compound with molecular formula C22H20O4 and molecular weight 348.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(16S,17R)-17-acetyloxy-11-methyl-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] acetate
Also Known As: Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-, 15H-Cyclopenta(a)phenanthrene-16,17-diol, 16,17-dihydro-11-methyl-, diacetate, cis-, 15H-Cyclopenta(a)phenanthrene-16,17-diol, 16,17-dihydro-11-methyl-, diacetate, trans-, 11-Methylgona-1(10),2,4,6,8(14),9(11),12-heptaene-16,17-diyl diacetate, [(16S,17R)-17-acetyloxy-11-methyl-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] acetate
| Molecular Formula | C22H20O4 |
|---|---|
| Molecular Weight | 348.14 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.13617 |
| Heavy Atoms | 26 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 42123-08-0 |
|---|---|
| SMILES | CC1=CC2=C(C[C@@H]([C@@H]2OC(=O)C)OC(=O)C)C3=C1C4=CC=CC=C4C=C3 |
| InChIKey | YBRVMFGQBNDICU-RBBKRZOGSA-N |
Product Overview
Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- (CAS 42123-08-0), with molecular formula C22H20O4 and molecular weight 348.14 g/mol. IUPAC: [(16S,17R)-17-acetyloxy-11-methyl-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] acetate.
Chemical Property Profile of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-
Property Insights of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-
The XLogP value of 4.5 indicates that Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- has 0 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 Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-?
The CAS number of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- is 42123-08-0.
What is the molecular formula of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-?
The molecular formula of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- is C22H20O4.
What is the molecular weight of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-?
The molecular weight of Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- is 348.14 g/mol.
Where can I buy Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-?
You can request a quote for Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Morphinan-3,8-alpha-diol, 4,5-alpha-epoxy-17-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.