![3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid structure](/static/products/1015/101585-37-9.webp)
3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid
TL;DR: 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid (CAS 101585-37-9) is a chemical compound with molecular formula C17H19NO4S and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoic acid
Also Known As: 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid, 3-(4-Methyl-N-(p-tolyl)phenylsulfonamido)propanoic acid, 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoic acid, beta-Alanine, N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-, 3-((4-Methyl-N-(p-tolyl)phenyl)sulfonamido)propanoic acid
| Molecular Formula | C17H19NO4S |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 2.97344 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.1035 |
| Heavy Atoms | 23 |
| Complexity | 780.348 |
Chemical Identifiers
| CAS Number | 101585-37-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(CCC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid (CAS 101585-37-9), with molecular formula C17H19NO4S and molecular weight 333.10 g/mol. IUPAC: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanoic acid.
Chemical Property Profile of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid
Property Insights of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid
The XLogP value of 2.97344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid. Following Lipinski's Rule of Five, 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid has 1 hydrogen bond donor(s) and 3 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-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid?
The CAS number of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid is 101585-37-9.
What is the molecular formula of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid?
The molecular formula of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid is C17H19NO4S.
What is the molecular weight of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid?
The molecular weight of 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid is 333.10 g/mol.
Where can I buy 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid?
You can request a quote for 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Toluene-4-sulfonyl)-p-tolyl-amino]-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.