![4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester structure](/static/products/324/324771-29-1.png)
4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester
TL;DR: 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester (CAS 324771-29-1) is a chemical compound with molecular formula C22H20N2O4S and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]amino]benzoate
Also Known As: BAS 01094913, Ethyl 4-(N'-(phenylsulfonyl)benzimidamido)benzoate, 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester, ethyl 4-[[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]amino]benzoate
| Molecular Formula | C22H20N2O4S |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | 4.1109 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.11438 |
| Heavy Atoms | 29 |
| Complexity | 1094.5688 |
Chemical Identifiers
| CAS Number | 324771-29-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N/C(=N/S(=O)(=O)C2=CC=CC=C2)/C3=CC=CC=C3 |
Product Overview
4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester (CAS 324771-29-1), with molecular formula C22H20N2O4S and molecular weight 408.11 g/mol. IUPAC: ethyl 4-[[(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl]amino]benzoate.
Chemical Property Profile of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester
Property Insights of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester
The XLogP value of 4.1109 indicates that 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester. Following Lipinski's Rule of Five, 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester has 1 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-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester?
The CAS number of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester is 324771-29-1.
What is the molecular formula of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester?
The molecular formula of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester is C22H20N2O4S.
What is the molecular weight of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester?
The molecular weight of 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester is 408.11 g/mol.
Where can I buy 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester?
You can request a quote for 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Benzenesulfonylimino-phenyl-methyl)-amino]-benzoic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.