5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)
TL;DR: 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) (CAS 64584-48-1) is a chemical compound with molecular formula C25H33N3O6 and molecular weight 471.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3Z,5S,8R,9S,10S,13S,14S,17S)-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-yl] nitrate
Also Known As: 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester), 17beta-Nitrooxy-5alpha-androstan-3-one O-(p-nitrophenyl)oxime, 17-beta-Hydroxy-5-alpha-androstan-3-one O-(p-nitrophenyl)oxime nitrate (ester), (1S,3aS,3bR,5aS,9aS,9bS,11aS)-9a,11a-dimethyl-7-[(4-nitrophenoxy)imino]-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl nitrate
| Molecular Formula | C25H33N3O6 |
|---|---|
| Molecular Weight | 471.24 g/mol |
| LogP | 5.9492 |
| Topological Polar Surface Area | 117.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.23694 |
| Heavy Atoms | 34 |
| Complexity | 996.87006 |
Chemical Identifiers
| CAS Number | 64584-48-1 |
|---|---|
| SMILES | C[C@]12CC/C(=N/OC3=CC=C(C=C3)[N+](=O)[O-])/C[C@@H]1CC[C@@H]4[C@@H]2CC[C@]5([C@H]4CC[C@@H]5O[N+](=O)[O-])C |
Product Overview
5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) (CAS 64584-48-1), with molecular formula C25H33N3O6 and molecular weight 471.24 g/mol. IUPAC: [(3Z,5S,8R,9S,10S,13S,14S,17S)-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-yl] nitrate.
Chemical Property Profile of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)
Property Insights of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)
The XLogP value of 5.9492 indicates that 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester). Following Lipinski's Rule of Five, 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)?
The CAS number of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) is 64584-48-1.
What is the molecular formula of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)?
The molecular formula of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) is C25H33N3O6.
What is the molecular weight of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)?
The molecular weight of 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) is 471.24 g/mol.
Where can I buy 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)?
You can request a quote for 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester)?
Yes, KEHONG BIO provides custom synthesis services for 5-alpha-Androstan-3-one, 17-beta-hydroxy-, O-(p-nitrophenyl)oxime, nitrate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.