![(S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester structure](/static/products/958/958984-07-1.png)
(S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester
TL;DR: (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester (CAS 958984-07-1) is a chemical compound with molecular formula C12H17N3O5S and molecular weight 315.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[(4-sulfamoylphenyl)methylcarbamoylamino]propanoate
Also Known As: (S)-methyl 2-(3-(4-sulfamoylbenzyl)ureido)propanoate, (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester, methyl (2S)-2-[(4-sulfamoylphenyl)methylcarbamoylamino]propanoate
| Molecular Formula | C12H17N3O5S |
|---|---|
| Molecular Weight | 315.09 g/mol |
| LogP | -0.3053 |
| Topological Polar Surface Area | 127.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.0889 |
| Heavy Atoms | 21 |
| Complexity | 612.285 |
Chemical Identifiers
| CAS Number | 958984-07-1 |
|---|---|
| SMILES | C[C@@H](C(=O)OC)NC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N |
Product Overview
(S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester (CAS 958984-07-1), with molecular formula C12H17N3O5S and molecular weight 315.09 g/mol. IUPAC: methyl (2S)-2-[(4-sulfamoylphenyl)methylcarbamoylamino]propanoate.
Chemical Property Profile of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester
Property Insights of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester
The XLogP value of -0.3053 indicates that (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.59 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester. Following Lipinski's Rule of Five, (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester has 3 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)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester?
The CAS number of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester is 958984-07-1.
What is the molecular formula of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester?
The molecular formula of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester is C12H17N3O5S.
What is the molecular weight of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester?
The molecular weight of (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester is 315.09 g/mol.
Where can I buy (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester?
You can request a quote for (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-[3-(4-Sulfamoyl-benzyl)-ureido]-propionic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.