![Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate structure](/static/products/327/327094-26-8.png)
Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate
TL;DR: Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate (CAS 327094-26-8) is a chemical compound with molecular formula C14H12ClNO4S and molecular weight 325.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(4-chlorophenyl)sulfonylamino]benzoate
Also Known As: methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate, BAS 00613726, BIM-0016331.P001, methyl 4-[(4-chlorophenyl)sulfonylamino]benzoate, 4-(4-Chloro-benzenesulfonylamino)-benzoic acid methyl ester
| Molecular Formula | C14H12ClNO4S |
|---|---|
| Molecular Weight | 325.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.01755 |
| Heavy Atoms | 21 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 327094-26-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)Cl |
| InChIKey | URVMQNGLXOXTJA-UHFFFAOYSA-N |
Product Overview
Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate (CAS 327094-26-8), with molecular formula C14H12ClNO4S and molecular weight 325.02 g/mol. IUPAC: methyl 4-[(4-chlorophenyl)sulfonylamino]benzoate.
Chemical Property Profile of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate
Property Insights of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate
The XLogP value of 3.2 indicates that Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate 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 Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate?
The CAS number of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate is 327094-26-8.
What is the molecular formula of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate?
The molecular formula of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate is C14H12ClNO4S.
What is the molecular weight of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate?
The molecular weight of Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate is 325.02 g/mol.
Where can I buy Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate?
You can request a quote for Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{[(4-chlorophenyl)sulfonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.