(2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid
TL;DR: (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid (CAS 82068-13-1) is a chemical compound with molecular formula C9H13NO4S2 and molecular weight 263.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid
Also Known As: BAS 12542442, (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid, (S)-3-Methyl-2-(thiophene-2-sulfonamido)butanoic acid, (S)-3-Methyl-2-(thiophene-2-sulfonylamino)-butyricacid, (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid
| Molecular Formula | C9H13NO4S2 |
|---|---|
| Molecular Weight | 263.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.0286 |
| Heavy Atoms | 16 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 82068-13-1 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC=CS1 |
| InChIKey | NFORIPALKNQHIR-QMMMGPOBSA-N |
Product Overview
(2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid (CAS 82068-13-1), with molecular formula C9H13NO4S2 and molecular weight 263.03 g/mol. IUPAC: (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid.
Chemical Property Profile of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid
Property Insights of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid. Following Lipinski's Rule of Five, (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid has 2 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 (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid?
The CAS number of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid is 82068-13-1.
What is the molecular formula of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid?
The molecular formula of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid is C9H13NO4S2.
What is the molecular weight of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid?
The molecular weight of (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid is 263.03 g/mol.
Where can I buy (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid?
You can request a quote for (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-3-methyl-2-(thiophene-2-sulfonamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.