2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime
TL;DR: 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime (CAS 64584-59-4) is a chemical compound with molecular formula C25H33ClN2O4 and molecular weight 460.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3E,5S,8R,9S,10S,13S,14S,17S)-2-chloro-10,13-dimethyl-3-(4-nitrophenoxy)imino-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-ol
Also Known As: Nisterimum, Nisterima, NISTERIME, Nisterime [INN], Nisterimum [INN-Latin]
| Molecular Formula | C25H33ClN2O4 |
|---|---|
| Molecular Weight | 460.21 g/mol |
| LogP | 5.9505 |
| Topological Polar Surface Area | 84.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 460.2129 |
| Heavy Atoms | 32 |
| Complexity | 921.0219 |
Chemical Identifiers
| CAS Number | 64584-59-4 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@H]4[C@@]3(C[C@H](/C(=N/OC5=CC=C(C=C5)[N+](=O)[O-])/C4)Cl)C |
Product Overview
2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime (CAS 64584-59-4), with molecular formula C25H33ClN2O4 and molecular weight 460.21 g/mol. IUPAC: (2R,3E,5S,8R,9S,10S,13S,14S,17S)-2-chloro-10,13-dimethyl-3-(4-nitrophenoxy)imino-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-ol.
Chemical Property Profile of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime
Property Insights of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime
The XLogP value of 5.9505 indicates that 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime. Following Lipinski's Rule of Five, 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime?
The CAS number of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime is 64584-59-4.
What is the molecular formula of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime?
The molecular formula of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime is C25H33ClN2O4.
What is the molecular weight of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime?
The molecular weight of 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime is 460.21 g/mol.
Where can I buy 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime?
You can request a quote for 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-alpha-Chloro-17-beta-hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.