![3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid structure](/static/products/317/31789-91-0.png)
3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid
TL;DR: 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid (CAS 31789-91-0) is a chemical compound with molecular formula C20H15ClN2O4S and molecular weight 414.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid
Also Known As: 3-[[N-(4-chlorophenyl)sulfonyl-C-phenyl-carbonimidoyl]amino]benzoic Acid, 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid
| Molecular Formula | C20H15ClN2O4S |
|---|---|
| Molecular Weight | 414.04 g/mol |
| LogP | 4.2858 |
| Topological Polar Surface Area | 95.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.0441 |
| Heavy Atoms | 28 |
| Complexity | 1128.382 |
Chemical Identifiers
| CAS Number | 31789-91-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=N\S(=O)(=O)C2=CC=C(C=C2)Cl)/NC3=CC=CC(=C3)C(=O)O |
Product Overview
3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid (CAS 31789-91-0), with molecular formula C20H15ClN2O4S and molecular weight 414.04 g/mol. IUPAC: 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid.
Chemical Property Profile of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid
Property Insights of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid
The XLogP value of 4.2858 indicates that 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid. Following Lipinski's Rule of Five, 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid has 2 hydrogen bond donor(s) and 3 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 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid?
The CAS number of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid is 31789-91-0.
What is the molecular formula of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid?
The molecular formula of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid is C20H15ClN2O4S.
What is the molecular weight of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid?
The molecular weight of 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid is 414.04 g/mol.
Where can I buy 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid?
You can request a quote for 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.