米非司酮氯化物
TL;DR: 米非司酮氯化物 (CAS 109345-60-0) is a chemical compound with molecular formula C30H38ClNO2 and molecular weight 479.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
米非司酮氯化物
[4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium chloride
Also Known As: Mifepristone methochloride, RU 486 Methochloride, [4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium chloride, [4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium,chloride, [4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium;chloride
| Molecular Formula | C30H38ClNO2 |
|---|---|
| Molecular Weight | 479.26 g/mol |
| LogP | 2.5412 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 479.2591 |
| Heavy Atoms | 34 |
| Complexity | 960.0 |
Chemical Identifiers
| CAS Number | 109345-60-0 |
|---|---|
| SMILES | CC#C[C@]1(CCC2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)[N+](C)(C)C)C)O.[Cl-] |
| InChIKey | BOYVMWBEQCZPAM-YHBHNODXSA-M |
Product Overview
米非司酮氯化物 (CAS 109345-60-0), with molecular formula C30H38ClNO2 and molecular weight 479.26 g/mol. IUPAC: [4-[(11R,13S,17R)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]-trimethylazanium chloride.
Chemical Property Profile of 米非司酮氯化物
Property Insights of 米非司酮氯化物
The XLogP value of 2.5412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 米非司酮氯化物. With a topological polar surface area (TPSA) of 37.3 Ų, 米非司酮氯化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 米非司酮氯化物 has 1 hydrogen bond donor(s) and 3 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 米非司酮氯化物?
The CAS number of 米非司酮氯化物 is 109345-60-0.
What is the molecular formula of 米非司酮氯化物?
The molecular formula of 米非司酮氯化物 is C30H38ClNO2.
What is the molecular weight of 米非司酮氯化物?
The molecular weight of 米非司酮氯化物 is 479.26 g/mol.
Where can I buy 米非司酮氯化物?
You can request a quote for 米非司酮氯化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 米非司酮氯化物?
Yes, KEHONG BIO provides custom synthesis services for 米非司酮氯化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.