(S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid
TL;DR: (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid (CAS 7685-65-6) is a chemical compound with molecular formula C9H10N2O4S and molecular weight 242.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(2-nitrophenyl)sulfanylamino]propanoic acid
Also Known As: N-(o-Nitrophenylthio)-L-alanine, N-o-nitrophenylsulfenyl-l-alanine, Alanine, N-[(2-nitrophenyl)thio]-, N-[(2-Nitrophenyl)thio]-L-alanine, N-[(2-Nitrophenyl)sulfanyl]-L-alanine
| Molecular Formula | C9H10N2O4S |
|---|---|
| Molecular Weight | 242.04 g/mol |
| LogP | 1.6646 |
| Topological Polar Surface Area | 92.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.03613 |
| Heavy Atoms | 16 |
| Complexity | 410.2504 |
Chemical Identifiers
| CAS Number | 7685-65-6 |
|---|---|
| SMILES | C[C@@H](C(=O)O)NSC1=CC=CC=C1[N+](=O)[O-] |
Product Overview
(S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid (CAS 7685-65-6), with molecular formula C9H10N2O4S and molecular weight 242.04 g/mol. IUPAC: (2S)-2-[(2-nitrophenyl)sulfanylamino]propanoic acid.
Chemical Property Profile of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid
Property Insights of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid
The XLogP value of 1.6646 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid. The TPSA of 92.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid. Following Lipinski's Rule of Five, (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid has 2 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-(((2-Nitrophenyl)thio)amino)propanoic acid?
The CAS number of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid is 7685-65-6.
What is the molecular formula of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid?
The molecular formula of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid is C9H10N2O4S.
What is the molecular weight of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid?
The molecular weight of (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid is 242.04 g/mol.
Where can I buy (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid?
You can request a quote for (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(((2-Nitrophenyl)thio)amino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.