9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one
TL;DR: 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one (CAS 742-80-3) is a chemical compound with molecular formula C20H28Cl2O2 and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9R,10S,11S,13S,14S,17S)-9,11-dichloro-17-hydroxy-10,13,17-trimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one, 9,11-dichloro-17-hydroxy-10,13,17-trimethyl-1,2,6,7,8,11,12,, 9a,21-Dichloro-11b,17-dihydroxy-16a-methylpregna-1,4-diene-3,20-dione, (8S,9R,10S,11S,13S,14S,17S)-9,11-dichloro-17-hydroxy-10,13,17-trimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one, 9,11-dichloro-17-hydroxy-10,13,17-trimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C20H28Cl2O2 |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 370.14664 |
| Heavy Atoms | 24 |
| Complexity | 631.0 |
Chemical Identifiers
| CAS Number | 742-80-3 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3CC[C@]4(C)O)C)Cl)Cl |
| InChIKey | QHZYYRQUMYKLQE-RBZZARIASA-N |
Product Overview
9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one (CAS 742-80-3), with molecular formula C20H28Cl2O2 and molecular weight 370.15 g/mol. IUPAC: (8S,9R,10S,11S,13S,14S,17S)-9,11-dichloro-17-hydroxy-10,13,17-trimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one
Property Insights of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one
The XLogP value of 3.9 indicates that 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one has 1 hydrogen bond donor(s) and 2 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 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one?
The CAS number of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one is 742-80-3.
What is the molecular formula of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one?
The molecular formula of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one is C20H28Cl2O2.
What is the molecular weight of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one?
The molecular weight of 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one is 370.15 g/mol.
Where can I buy 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one?
You can request a quote for 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 9,11-Dichloro-17-hydroxy-17-methylandrost-4-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.