氯地孕酮
TL;DR: 氯地孕酮 (CAS 1961-77-9) is a chemical compound with molecular formula C21H27ClO3 and molecular weight 362.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯地孕酮
(9S,14S,17R)-17-acetyl-6-chloro-17-hydroxy-10,13-dimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: Chlormadinone, Chlormadinon, chlormadinone acetate, Clormadinone [DCIT], Chlormadinone [INN:BAN]
| Molecular Formula | C21H27ClO3 |
|---|---|
| Molecular Weight | 362.16 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.1649 |
| Heavy Atoms | 25 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 1961-77-9 |
|---|---|
| SMILES | CC(=O)[C@]1(CC[C@@H]2C1(CC[C@H]3C2C=C(C4=CC(=O)CCC34C)Cl)C)O |
| InChIKey | VUHJZBBCZGVNDZ-RVIHVPCJSA-N |
Product Overview
氯地孕酮 (CAS 1961-77-9), with molecular formula C21H27ClO3 and molecular weight 362.16 g/mol. IUPAC: (9S,14S,17R)-17-acetyl-6-chloro-17-hydroxy-10,13-dimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 氯地孕酮
Property Insights of 氯地孕酮
The XLogP value of 3.0 indicates that 氯地孕酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 氯地孕酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯地孕酮 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 氯地孕酮?
The CAS number of 氯地孕酮 is 1961-77-9.
What is the molecular formula of 氯地孕酮?
The molecular formula of 氯地孕酮 is C21H27ClO3.
What is the molecular weight of 氯地孕酮?
The molecular weight of 氯地孕酮 is 362.16 g/mol.
Where can I buy 氯地孕酮?
You can request a quote for 氯地孕酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯地孕酮?
Yes, KEHONG BIO provides custom synthesis services for 氯地孕酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.