7-Oxoandrostane-3,17-diyl diacetate
TL;DR: 7-Oxoandrostane-3,17-diyl diacetate (CAS 13231-00-0) is a chemical compound with molecular formula C23H34O5 and molecular weight 390.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(17-acetyloxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl) acetate
Also Known As: 7-oxoandrostane-3,17-diyl diacetate, (3alpha)-3,17-dihydroxy-pregn-5-en-20-one, (17-acetyloxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl) acetate, [(8R,9S,10S,13S,14S)-17-acetyloxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
| Molecular Formula | C23H34O5 |
|---|---|
| Molecular Weight | 390.24 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.24063 |
| Heavy Atoms | 28 |
| Complexity | 686.0 |
Chemical Identifiers
| CAS Number | 13231-00-0 |
|---|---|
| SMILES | CC(=O)OC1CCC2(C3CCC4(C(C3C(=O)CC2C1)CCC4OC(=O)C)C)C |
| InChIKey | ICLVBZVECAGRBZ-UHFFFAOYSA-N |
Product Overview
7-Oxoandrostane-3,17-diyl diacetate (CAS 13231-00-0), with molecular formula C23H34O5 and molecular weight 390.24 g/mol. IUPAC: (17-acetyloxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl) acetate.
Chemical Property Profile of 7-Oxoandrostane-3,17-diyl diacetate
Property Insights of 7-Oxoandrostane-3,17-diyl diacetate
The XLogP value of 3.7 indicates that 7-Oxoandrostane-3,17-diyl diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Oxoandrostane-3,17-diyl diacetate. Following Lipinski's Rule of Five, 7-Oxoandrostane-3,17-diyl diacetate has 0 hydrogen bond donor(s) and 5 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 7-Oxoandrostane-3,17-diyl diacetate?
The CAS number of 7-Oxoandrostane-3,17-diyl diacetate is 13231-00-0.
What is the molecular formula of 7-Oxoandrostane-3,17-diyl diacetate?
The molecular formula of 7-Oxoandrostane-3,17-diyl diacetate is C23H34O5.
What is the molecular weight of 7-Oxoandrostane-3,17-diyl diacetate?
The molecular weight of 7-Oxoandrostane-3,17-diyl diacetate is 390.24 g/mol.
Where can I buy 7-Oxoandrostane-3,17-diyl diacetate?
You can request a quote for 7-Oxoandrostane-3,17-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Oxoandrostane-3,17-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for 7-Oxoandrostane-3,17-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.