(17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate
TL;DR: (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate (CAS 84368-89-8) is a chemical compound with molecular formula C21H31NO3 and molecular weight 345.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,8R,9S,10R,13S,14S,17E)-17-hydroxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Also Known As: Abiraterone Impurity 32, (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate, (3S,8R,9S,10R,13S,14S,E)-17-(hydroxyimino)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate, [(3S,8R,9S,10R,13S,14S,17Z)-17-hydroxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
| Molecular Formula | C21H31NO3 |
|---|---|
| Molecular Weight | 345.23 g/mol |
| LogP | 4.7111 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 345.2304 |
| Heavy Atoms | 25 |
| Complexity | 639.0524 |
Chemical Identifiers
| CAS Number | 84368-89-8 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]\4([C@H]([C@@H]3CC=C2C1)CC/C4=N\O)C)C |
Product Overview
(17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate (CAS 84368-89-8), with molecular formula C21H31NO3 and molecular weight 345.23 g/mol. IUPAC: [(3S,8R,9S,10R,13S,14S,17E)-17-hydroxyimino-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate
Property Insights of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate
The XLogP value of 4.7111 indicates that (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.89 Ų, (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate has 1 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 (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate?
The CAS number of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate is 84368-89-8.
What is the molecular formula of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate?
The molecular formula of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate is C21H31NO3.
What is the molecular weight of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate?
The molecular weight of (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate is 345.23 g/mol.
Where can I buy (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate?
You can request a quote for (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for (17E)-17-(Hydroxyimino)androst-5-en-3beta-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.