17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione
TL;DR: 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione (CAS 14147-97-8) is a chemical compound with molecular formula C21H26O3 and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9R,10R,13S,17R)-17-acetyl-17-hydroxy-10,13-dimethyl-2,9,11,12,15,16-hexahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: BDHP, 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione, 6,8(14)-Bisdehydro-17-hydroxyprogesterone, 17-hydroxypregna-4,6,8(14)-triene-3,20-dione, Pregna-4,6,8(14)-triene-3,20-dione, 17-hydroxy-
| Molecular Formula | C21H26O3 |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.1882 |
| Heavy Atoms | 24 |
| Complexity | 740.0 |
Chemical Identifiers
| CAS Number | 14147-97-8 |
|---|---|
| SMILES | CC(=O)[C@]1(CCC2=C3C=CC4=CC(=O)CC[C@@]4([C@H]3CC[C@@]21C)C)O |
| InChIKey | IDIHGZAZUJGAEB-VMXMFDLUSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione (CAS 14147-97-8), with molecular formula C21H26O3 and molecular weight 326.19 g/mol. IUPAC: (9R,10R,13S,17R)-17-acetyl-17-hydroxy-10,13-dimethyl-2,9,11,12,15,16-hexahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione
Property Insights of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-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 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione?
The CAS number of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione is 14147-97-8.
What is the molecular formula of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione?
The molecular formula of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione is C21H26O3.
What is the molecular weight of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione?
The molecular weight of 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione is 326.19 g/mol.
Where can I buy 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione?
You can request a quote for 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 17-Hydroxy-4,6,8(14)-pregnatriene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.