3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid
TL;DR: 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid (CAS 175201-89-5) is a chemical compound with molecular formula C8H11NO4S2 and molecular weight 249.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-propan-2-ylsulfonylthiophene-2-carboxylic acid
Also Known As: 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid, Maybridge1_004642, 3-amino-4-propan-2-ylsulfonylthiophene-2-carboxylic acid, 3-amino-4-(propane-2-sulfonyl)thiophene-2-carboxylic acid, 2-Thiophenecarboxylic acid, 3-amino-4-[(1-methylethyl)sulfonyl]-
| Molecular Formula | C8H11NO4S2 |
|---|---|
| Molecular Weight | 249.01 g/mol |
| LogP | 1.2106 |
| Topological Polar Surface Area | 97.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.01295 |
| Heavy Atoms | 15 |
| Complexity | 486.74 |
Chemical Identifiers
| CAS Number | 175201-89-5 |
|---|---|
| SMILES | CC(C)S(=O)(=O)C1=CSC(=C1N)C(=O)O |
Product Overview
3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid (CAS 175201-89-5), with molecular formula C8H11NO4S2 and molecular weight 249.01 g/mol. IUPAC: 3-amino-4-propan-2-ylsulfonylthiophene-2-carboxylic acid.
Chemical Property Profile of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid
Property Insights of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid
The XLogP value of 1.2106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid. The TPSA of 97.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid has 2 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 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid?
The CAS number of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid is 175201-89-5.
What is the molecular formula of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid?
The molecular formula of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid is C8H11NO4S2.
What is the molecular weight of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid?
The molecular weight of 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid is 249.01 g/mol.
Where can I buy 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid?
You can request a quote for 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-4-(isopropylsulfonyl)thiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.