![(2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid structure](/static/products/372/3728-29-8.png)
(2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid
TL;DR: (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid (CAS 3728-29-8) is a chemical compound with molecular formula C25H34O6 and molecular weight 430.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(3,17-diacetyloxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-ylidene)acetic acid
Also Known As: (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid, (2E)-2-(3,17-diacetyloxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-ylidene)acetic acid
| Molecular Formula | C25H34O6 |
|---|---|
| Molecular Weight | 430.24 g/mol |
| LogP | 4.4335 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 430.23553 |
| Heavy Atoms | 31 |
| Complexity | 856.07355 |
Chemical Identifiers
| CAS Number | 3728-29-8 |
|---|---|
| SMILES | CC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)C/C(=C\C(=O)O)/C4OC(=O)C)C)C |
Product Overview
(2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid (CAS 3728-29-8), with molecular formula C25H34O6 and molecular weight 430.24 g/mol. IUPAC: (2E)-2-(3,17-diacetyloxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-ylidene)acetic acid.
Chemical Property Profile of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid
Property Insights of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid
The XLogP value of 4.4335 indicates that (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid. Following Lipinski's Rule of Five, (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid has 1 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 (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid?
The CAS number of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid is 3728-29-8.
What is the molecular formula of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid?
The molecular formula of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid is C25H34O6.
What is the molecular weight of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid?
The molecular weight of (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid is 430.24 g/mol.
Where can I buy (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid?
You can request a quote for (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-[(16E)-3,17-Bis(acetyloxy)androst-5-en-16-ylidene]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.