N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine
TL;DR: N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine (CAS 958960-97-9) is a chemical compound with molecular formula C16H17N3O5S and molecular weight 363.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-phenyl-2-[(4-sulfamoylphenyl)carbamoylamino]propanoic acid
Also Known As: N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine, (S)-3-phenyl-2-(3-(4-sulfamoylphenyl)ureido)propanoic acid, (2S)-3-phenyl-2-[(4-sulfamoylphenyl)carbamoylamino]propanoic acid
| Molecular Formula | C16H17N3O5S |
|---|---|
| Molecular Weight | 363.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.0889 |
| Heavy Atoms | 25 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 958960-97-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)N |
| InChIKey | WPKKKCRKIPKXRN-AWEZNQCLSA-N |
Product Overview
N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine (CAS 958960-97-9), with molecular formula C16H17N3O5S and molecular weight 363.09 g/mol. IUPAC: (2S)-3-phenyl-2-[(4-sulfamoylphenyl)carbamoylamino]propanoic acid.
Chemical Property Profile of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine
Property Insights of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine. The TPSA of 147.0 Ų indicates high polarity, suggesting N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine has 4 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 N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine?
The CAS number of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine is 958960-97-9.
What is the molecular formula of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine?
The molecular formula of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine is C16H17N3O5S.
What is the molecular weight of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine?
The molecular weight of N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine is 363.09 g/mol.
Where can I buy N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine?
You can request a quote for N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-sulfamoylphenyl)carbamoyl]-L-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.