Methyl 4-(thiophen-2-ylsulfonylamino)benzoate
TL;DR: Methyl 4-(thiophen-2-ylsulfonylamino)benzoate (CAS 380342-27-8) is a chemical compound with molecular formula C12H11NO4S2 and molecular weight 297.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(thiophen-2-ylsulfonylamino)benzoate
Also Known As: methyl 4-(thiophen-2-ylsulfonylamino)benzoate, methyl 4-[(2-thienylsulfonyl)amino]benzoate, BAS 08206025, methyl 4-(thiophene-2-sulfonamido)benzoate, 4-(Thiophene-2-sulfonylamino)-benzoic acid methyl ester
| Molecular Formula | C12H11NO4S2 |
|---|---|
| Molecular Weight | 297.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.01294 |
| Heavy Atoms | 19 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 380342-27-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CS2 |
| InChIKey | VGMPZUWIMVYLII-UHFFFAOYSA-N |
Product Overview
Methyl 4-(thiophen-2-ylsulfonylamino)benzoate (CAS 380342-27-8), with molecular formula C12H11NO4S2 and molecular weight 297.01 g/mol. IUPAC: methyl 4-(thiophen-2-ylsulfonylamino)benzoate.
Chemical Property Profile of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate
Property Insights of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(thiophen-2-ylsulfonylamino)benzoate. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(thiophen-2-ylsulfonylamino)benzoate. Following Lipinski's Rule of Five, Methyl 4-(thiophen-2-ylsulfonylamino)benzoate has 1 hydrogen bond donor(s) and 6 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-(thiophen-2-ylsulfonylamino)benzoate?
The CAS number of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate is 380342-27-8.
What is the molecular formula of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate?
The molecular formula of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate is C12H11NO4S2.
What is the molecular weight of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate?
The molecular weight of Methyl 4-(thiophen-2-ylsulfonylamino)benzoate is 297.01 g/mol.
Where can I buy Methyl 4-(thiophen-2-ylsulfonylamino)benzoate?
You can request a quote for Methyl 4-(thiophen-2-ylsulfonylamino)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-(thiophen-2-ylsulfonylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(thiophen-2-ylsulfonylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.