炔诺醇双醋酸酯
TL;DR: 炔诺醇双醋酸酯 (CAS 297-76-7) is a chemical compound with molecular formula C24H32O4 and molecular weight 384.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
炔诺醇双醋酸酯
(17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate
Also Known As: ETHYNODIOL DIACETATE, Cervicundin, Luteonorm, Metrodiol, Femulen
| Molecular Formula | C24H32O4 |
|---|---|
| Molecular Weight | 384.23 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.23007 |
| Heavy Atoms | 28 |
| Complexity | 758.0 |
Chemical Identifiers
| CAS Number | 297-76-7 |
|---|---|
| SMILES | CC(=O)OC1CCC2C3CCC4(C(C3CCC2=C1)CCC4(C#C)OC(=O)C)C |
| InChIKey | ONKUMRGIYFNPJW-UHFFFAOYSA-N |
Product Overview
炔诺醇双醋酸酯 (CAS 297-76-7), with molecular formula C24H32O4 and molecular weight 384.23 g/mol. IUPAC: (17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate.
Chemical Property Profile of 炔诺醇双醋酸酯
Property Insights of 炔诺醇双醋酸酯
The XLogP value of 3.9 indicates that 双醋炔诺酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 炔诺醇双醋酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双醋炔诺酮 has 0 hydrogen bond donor(s) and 4 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 双醋炔诺酮?
The CAS number of 双醋炔诺酮 is 297-76-7.
What is the molecular formula of 双醋炔诺酮?
The molecular formula of 双醋炔诺酮 is C24H32O4.
What is the molecular weight of 双醋炔诺酮?
The molecular weight of 双醋炔诺酮 is 384.23 g/mol.
Where can I buy 双醋炔诺酮?
You can request a quote for 双醋炔诺酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双醋炔诺酮?
Yes, KEHONG BIO provides custom synthesis services for 双醋炔诺酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.