3-Cholestenone isonicotinoyl hydrazone
TL;DR: 3-Cholestenone isonicotinoyl hydrazone (CAS 17129-51-0) is a chemical compound with molecular formula C33H49N3O and molecular weight 503.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]pyridine-4-carboxamide
Also Known As: INH cholest deriv., 3-Cholestenone isonicotinoyl hydrazone, Isonicotinic acid, cholest-4-en-3-ylidenehydrazide, N-[(E)-[(8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]pyridine-4-carboxamide
| Molecular Formula | C33H49N3O |
|---|---|
| Molecular Weight | 503.39 g/mol |
| LogP | 8.2088 |
| Topological Polar Surface Area | 54.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 503.38757 |
| Heavy Atoms | 37 |
| Complexity | 1029.2635 |
Chemical Identifiers
| CAS Number | 17129-51-0 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC/C(=N\NC(=O)C5=CC=NC=C5)/C4)C)C |
Product Overview
3-Cholestenone isonicotinoyl hydrazone (CAS 17129-51-0), with molecular formula C33H49N3O and molecular weight 503.39 g/mol. IUPAC: N-[(E)-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene]amino]pyridine-4-carboxamide.
Chemical Property Profile of 3-Cholestenone isonicotinoyl hydrazone
Property Insights of 3-Cholestenone isonicotinoyl hydrazone
The XLogP value of 8.2088 indicates that 3-Cholestenone isonicotinoyl hydrazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.35 Ų, 3-Cholestenone isonicotinoyl hydrazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cholestenone isonicotinoyl hydrazone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Cholestenone isonicotinoyl hydrazone?
The CAS number of 3-Cholestenone isonicotinoyl hydrazone is 17129-51-0.
What is the molecular formula of 3-Cholestenone isonicotinoyl hydrazone?
The molecular formula of 3-Cholestenone isonicotinoyl hydrazone is C33H49N3O.
What is the molecular weight of 3-Cholestenone isonicotinoyl hydrazone?
The molecular weight of 3-Cholestenone isonicotinoyl hydrazone is 503.39 g/mol.
Where can I buy 3-Cholestenone isonicotinoyl hydrazone?
You can request a quote for 3-Cholestenone isonicotinoyl hydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cholestenone isonicotinoyl hydrazone?
Yes, KEHONG BIO provides custom synthesis services for 3-Cholestenone isonicotinoyl hydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.