17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime
TL;DR: 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime (CAS 64584-79-8) is a chemical compound with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z,8R,9S,10R,13S,14S)-17-ethynyl-13-methyl-3-(4-nitrophenoxy)imino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
Also Known As: 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime, 19-Nor-17-alpha-pregn-4-en-20-yn-3-one, 17-hydroxy-, O-(p-nitrophenyl)oxime
| Molecular Formula | C26H30N2O4 |
|---|---|
| Molecular Weight | 434.22 g/mol |
| LogP | 5.2666 |
| Topological Polar Surface Area | 84.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.22055 |
| Heavy Atoms | 32 |
| Complexity | 1023.2576 |
Chemical Identifiers
| CAS Number | 64584-79-8 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#C)O)CCC4=C/C(=N\OC5=CC=C(C=C5)[N+](=O)[O-])/CC[C@H]34 |
Product Overview
17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime (CAS 64584-79-8), with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol. IUPAC: (3Z,8R,9S,10R,13S,14S)-17-ethynyl-13-methyl-3-(4-nitrophenoxy)imino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol.
Chemical Property Profile of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime
Property Insights of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime
The XLogP value of 5.2666 indicates that 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-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 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime. Following Lipinski's Rule of Five, 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-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 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime?
The CAS number of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime is 64584-79-8.
What is the molecular formula of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime?
The molecular formula of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime is C26H30N2O4.
What is the molecular weight of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime?
The molecular weight of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime is 434.22 g/mol.
Where can I buy 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime?
You can request a quote for 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-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 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.