![Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate structure](/static/products/902/902693-29-2.png)
Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate
TL;DR: Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate (CAS 902693-29-2) is a chemical compound with molecular formula C14H11F2NO4S and molecular weight 327.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(2,4-difluorophenyl)sulfonylamino]benzoate
Also Known As: methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate, methyl 4-[(2,4-difluorophenyl)sulfonylamino]benzoate, AO-854/43447402
| Molecular Formula | C14H11F2NO4S |
|---|---|
| Molecular Weight | 327.04 g/mol |
| LogP | 2.5522 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.0377 |
| Heavy Atoms | 22 |
| Complexity | 804.0926 |
Chemical Identifiers
| CAS Number | 902693-29-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=C(C=C2)F)F |
Product Overview
Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate (CAS 902693-29-2), with molecular formula C14H11F2NO4S and molecular weight 327.04 g/mol. IUPAC: methyl 4-[(2,4-difluorophenyl)sulfonylamino]benzoate.
Chemical Property Profile of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate
Property Insights of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate
The XLogP value of 2.5522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate 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 Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate?
The CAS number of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate is 902693-29-2.
What is the molecular formula of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate?
The molecular formula of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate is C14H11F2NO4S.
What is the molecular weight of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate?
The molecular weight of Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate is 327.04 g/mol.
Where can I buy Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate?
You can request a quote for Methyl 4-{[(2,4-difluorophenyl)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-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{[(2,4-difluorophenyl)sulfonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.