6 Beta-hydroxyestr-4-ene-3,17-dione
TL;DR: 6 Beta-hydroxyestr-4-ene-3,17-dione (CAS 5949-49-5) is a chemical compound with molecular formula C18H24O3 and molecular weight 288.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,8R,9S,10R,13S,14S)-6-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione
Also Known As: 6beta-Hydroxyestr-4-ene-3,17-dione, 6-Beta-Hydroxy-19-Norandrostenedione, 6-hydroxyestr-4-ene-3,17-dione, A-hydroxy-19-norandrostenedione, 6 beta-hydroxyestr-4-ene-3,17-dione
| Molecular Formula | C18H24O3 |
|---|---|
| Molecular Weight | 288.17 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 288.17255 |
| Heavy Atoms | 21 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 5949-49-5 |
|---|---|
| SMILES | C[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4[C@@H](C[C@H]3[C@@H]1CCC2=O)O |
| InChIKey | FCGVJIQPGVYHQN-QRJTWQJVSA-N |
Product Overview
6 Beta-hydroxyestr-4-ene-3,17-dione (CAS 5949-49-5), with molecular formula C18H24O3 and molecular weight 288.17 g/mol. IUPAC: (6R,8R,9S,10R,13S,14S)-6-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione.
Chemical Property Profile of 6 Beta-hydroxyestr-4-ene-3,17-dione
Property Insights of 6 Beta-hydroxyestr-4-ene-3,17-dione
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6 Beta-hydroxyestr-4-ene-3,17-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 6 Beta-hydroxyestr-4-ene-3,17-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6 Beta-hydroxyestr-4-ene-3,17-dione 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 6 Beta-hydroxyestr-4-ene-3,17-dione?
The CAS number of 6 Beta-hydroxyestr-4-ene-3,17-dione is 5949-49-5.
What is the molecular formula of 6 Beta-hydroxyestr-4-ene-3,17-dione?
The molecular formula of 6 Beta-hydroxyestr-4-ene-3,17-dione is C18H24O3.
What is the molecular weight of 6 Beta-hydroxyestr-4-ene-3,17-dione?
The molecular weight of 6 Beta-hydroxyestr-4-ene-3,17-dione is 288.17 g/mol.
Where can I buy 6 Beta-hydroxyestr-4-ene-3,17-dione?
You can request a quote for 6 Beta-hydroxyestr-4-ene-3,17-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6 Beta-hydroxyestr-4-ene-3,17-dione?
Yes, KEHONG BIO provides custom synthesis services for 6 Beta-hydroxyestr-4-ene-3,17-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.