![(S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid structure](/static/products/958/958952-23-3.png)
(S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid
TL;DR: (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid (CAS 958952-23-3) is a chemical compound with molecular formula C12H17N3O5S2 and molecular weight 347.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methylsulfanyl-2-[(4-sulfamoylphenyl)carbamoylamino]butanoic acid
Also Known As: N-[(4-sulfamoylphenyl)carbamoyl]-L-methionine, (S)-4-(methylthio)-2-(3-(4-sulfamoylphenyl)ureido)butanoic acid, 4-methylsulfanyl-2-[(4-sulfamoylphenyl)carbamoylamino]butanoic Acid, (2S)-4-methylsulfanyl-2-[(4-sulfamoylphenyl)carbamoylamino]butanoic acid, (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid
| Molecular Formula | C12H17N3O5S2 |
|---|---|
| Molecular Weight | 347.06 g/mol |
| LogP | 0.6618 |
| Topological Polar Surface Area | 138.59 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.06097 |
| Heavy Atoms | 22 |
| Complexity | 630.66675 |
Chemical Identifiers
| CAS Number | 958952-23-3 |
|---|---|
| SMILES | CSCC[C@@H](C(=O)O)NC(=O)NC1=CC=C(C=C1)S(=O)(=O)N |
Product Overview
(S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid (CAS 958952-23-3), with molecular formula C12H17N3O5S2 and molecular weight 347.06 g/mol. IUPAC: (2S)-4-methylsulfanyl-2-[(4-sulfamoylphenyl)carbamoylamino]butanoic acid.
Chemical Property Profile of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid
Property Insights of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid
The XLogP value of 0.6618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid. The TPSA of 138.59 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid. Following Lipinski's Rule of Five, (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid has 4 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 (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid?
The CAS number of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid is 958952-23-3.
What is the molecular formula of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid?
The molecular formula of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid is C12H17N3O5S2.
What is the molecular weight of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid?
The molecular weight of (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid is 347.06 g/mol.
Where can I buy (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid?
You can request a quote for (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-Methylsulfanyl-2-[3-(4-sulfamoyl-phenyl)-ureido]-butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.