![4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide structure](/static/products/4450/445000-57-7.webp)
4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide
TL;DR: 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide (CAS 445000-57-7) is a chemical compound with molecular formula C22H20ClN3O3S and molecular weight 441.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[3-[C-methyl-N-[(4-methylphenyl)sulfonylamino]carbonimidoyl]phenyl]benzamide
Also Known As: 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide, 3-Chloro-N-(3-{1-[2-(4-methylbenzene-1-sulfonyl)hydrazinylidene]ethyl}phenyl)benzamide, 3-chloro-N-[3-[C-methyl-N-[(4-methylphenyl)sulfonylamino]carbonimidoyl]phenyl]benzamide, 3-CHLORO-N-{3-[(1E)-1-[(4-METHYLBENZENESULFONAMIDO)IMINO]ETHYL]PHENYL}BENZAMIDE
| Molecular Formula | C22H20ClN3O3S |
|---|---|
| Molecular Weight | 441.09 g/mol |
| LogP | 4.60322 |
| Topological Polar Surface Area | 87.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.0914 |
| Heavy Atoms | 30 |
| Complexity | 1206.3073 |
Chemical Identifiers
| CAS Number | 445000-57-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NN=C(C)C2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Cl |
Product Overview
4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide (CAS 445000-57-7), with molecular formula C22H20ClN3O3S and molecular weight 441.09 g/mol. IUPAC: 3-chloro-N-[3-[C-methyl-N-[(4-methylphenyl)sulfonylamino]carbonimidoyl]phenyl]benzamide.
Chemical Property Profile of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide
Property Insights of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide
The XLogP value of 4.60322 indicates that 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide. Following Lipinski's Rule of Five, 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide has 2 hydrogen bond donor(s) and 4 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 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide?
The CAS number of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide is 445000-57-7.
What is the molecular formula of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide?
The molecular formula of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide is C22H20ClN3O3S.
What is the molecular weight of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide?
The molecular weight of 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide is 441.09 g/mol.
Where can I buy 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide?
You can request a quote for 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylbenzenesulfonic acid 2-[1-[3-[(3-chlorobenzoyl)amino]phenyl]ethylidene]hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.