Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide
TL;DR: Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide (CAS 83794-60-9) is a chemical compound with molecular formula C19H21N3O3S and molecular weight 371.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(E)-3-methyl-5-(4-methylphenyl)sulfonylpent-3-en-2-ylidene]amino]pyridine-4-carboxamide
Also Known As: Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide, (1,2-Dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide of isonicotinic acid, 4-Pyridinecarboxylic acid, (1,2-dimethyl-4-((4-methylphenyl)sulfonyl)-2-butenylidene)hydrazine, N -[1,2-Dimethyl-4-[(p-tolyl)sulfonyl]-2-butenylidene]isonicotinic hydrazide, N'-[3-methyl-5-(4-methylbenzenesulfonyl)pent-3-en-2-ylidene]pyridine-4-carbohydrazide
| Molecular Formula | C19H21N3O3S |
|---|---|
| Molecular Weight | 371.13 g/mol |
| LogP | 2.91592 |
| Topological Polar Surface Area | 88.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.13037 |
| Heavy Atoms | 26 |
| Complexity | 931.75446 |
Chemical Identifiers
| CAS Number | 83794-60-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C/C=C(\C)/C(=N/NC(=O)C2=CC=NC=C2)/C |
Product Overview
Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide (CAS 83794-60-9), with molecular formula C19H21N3O3S and molecular weight 371.13 g/mol. IUPAC: N-[(E)-[(E)-3-methyl-5-(4-methylphenyl)sulfonylpent-3-en-2-ylidene]amino]pyridine-4-carboxamide.
Chemical Property Profile of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide
Property Insights of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide
The XLogP value of 2.91592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide. The TPSA of 88.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide. Following Lipinski's Rule of Five, Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide has 1 hydrogen bond donor(s) and 5 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 Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide?
The CAS number of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide is 83794-60-9.
What is the molecular formula of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide?
The molecular formula of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide is C19H21N3O3S.
What is the molecular weight of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide?
The molecular weight of Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide is 371.13 g/mol.
Where can I buy Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide?
You can request a quote for Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for Isonicotinic acid, (1,2-dimethyl-4-(p-tolylsulfonyl)2-butenylidene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.