2-(4-Methylbenzenesulfonamido)butanedioic acid
TL;DR: 2-(4-Methylbenzenesulfonamido)butanedioic acid (CAS 190773-33-2) is a chemical compound with molecular formula C11H13NO6S and molecular weight 287.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylphenyl)sulfonylamino]butanedioic acid
Also Known As: N-Tosyl-L-aspartic acid, N-Tosylaspartic acid, EINECS 225-391-7, 2-(4-methylbenzenesulfonamido)butanedioic acid, n-[(4-methylphenyl)sulfonyl]-l-aspartic acid
| Molecular Formula | C11H13NO6S |
|---|---|
| Molecular Weight | 287.05 g/mol |
| LogP | 0.20122 |
| Topological Polar Surface Area | 120.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.04636 |
| Heavy Atoms | 19 |
| Complexity | 577.7079 |
Chemical Identifiers
| CAS Number | 190773-33-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C(=O)O |
Product Overview
2-(4-Methylbenzenesulfonamido)butanedioic acid (CAS 190773-33-2), with molecular formula C11H13NO6S and molecular weight 287.05 g/mol. IUPAC: 2-[(4-methylphenyl)sulfonylamino]butanedioic acid.
Chemical Property Profile of 2-(4-Methylbenzenesulfonamido)butanedioic acid
Property Insights of 2-(4-Methylbenzenesulfonamido)butanedioic acid
The XLogP value of 0.20122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methylbenzenesulfonamido)butanedioic acid. The TPSA of 120.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methylbenzenesulfonamido)butanedioic acid. Following Lipinski's Rule of Five, 2-(4-Methylbenzenesulfonamido)butanedioic acid has 3 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 2-(4-Methylbenzenesulfonamido)butanedioic acid?
The CAS number of 2-(4-Methylbenzenesulfonamido)butanedioic acid is 190773-33-2.
What is the molecular formula of 2-(4-Methylbenzenesulfonamido)butanedioic acid?
The molecular formula of 2-(4-Methylbenzenesulfonamido)butanedioic acid is C11H13NO6S.
What is the molecular weight of 2-(4-Methylbenzenesulfonamido)butanedioic acid?
The molecular weight of 2-(4-Methylbenzenesulfonamido)butanedioic acid is 287.05 g/mol.
Where can I buy 2-(4-Methylbenzenesulfonamido)butanedioic acid?
You can request a quote for 2-(4-Methylbenzenesulfonamido)butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methylbenzenesulfonamido)butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylbenzenesulfonamido)butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.