Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate
TL;DR: Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate (CAS 895261-32-2) is a chemical compound with molecular formula C13H11NO6S2 and molecular weight 341.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate
Also Known As: methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate, VU0511579-1, F3166-0046, methyl 3-(N-(benzo[d][1,3]dioxol-5-yl)sulfamoyl)thiophene-2-carboxylate, Methyl 3-(benzo[1,3]dioxol-5-ylsulfamoyl)thiophene-2-carboxylate
| Molecular Formula | C13H11NO6S2 |
|---|---|
| Molecular Weight | 341.00 g/mol |
| LogP | 2.0642 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.00278 |
| Heavy Atoms | 22 |
| Complexity | 826.8059 |
Chemical Identifiers
| CAS Number | 895261-32-2 |
|---|---|
| SMILES | COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate (CAS 895261-32-2), with molecular formula C13H11NO6S2 and molecular weight 341.00 g/mol. IUPAC: methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate
Property Insights of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate
The XLogP value of 2.0642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate has 1 hydrogen bond donor(s) and 7 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 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate?
The CAS number of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate is 895261-32-2.
What is the molecular formula of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate?
The molecular formula of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate is C13H11NO6S2.
What is the molecular weight of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate?
The molecular weight of Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate is 341.00 g/mol.
Where can I buy Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate?
You can request a quote for Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(1,3-benzodioxol-5-ylsulfamoyl)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.