N-((o-Nitrophenyl)thio)-L-threonine
TL;DR: N-((o-Nitrophenyl)thio)-L-threonine (CAS 7685-70-3) is a chemical compound with molecular formula C10H12N2O5S and molecular weight 272.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-3-hydroxy-2-[(2-nitrophenyl)sulfanylamino]butanoic acid
Also Known As: N-[ thio]-L-threonine, N-((o-Nitrophenyl)thio)-L-threonine, o-nitrophenylsulfenyl-l-threonine, N-[(2-Nitrophenyl)thio]-L-threonine, N-[(o-Nitrophenyl)thio]-L-threonine
| Molecular Formula | C10H12N2O5S |
|---|---|
| Molecular Weight | 272.05 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.0467 |
| Heavy Atoms | 18 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 7685-70-3 |
|---|---|
| SMILES | C[C@H]([C@@H](C(=O)O)NSC1=CC=CC=C1[N+](=O)[O-])O |
| InChIKey | QJMPRIHAPGGFMA-MUWHJKNJSA-N |
Product Overview
N-((o-Nitrophenyl)thio)-L-threonine (CAS 7685-70-3), with molecular formula C10H12N2O5S and molecular weight 272.05 g/mol. IUPAC: (2S,3R)-3-hydroxy-2-[(2-nitrophenyl)sulfanylamino]butanoic acid.
Chemical Property Profile of N-((o-Nitrophenyl)thio)-L-threonine
Property Insights of N-((o-Nitrophenyl)thio)-L-threonine
The XLogP value of -1.3 indicates that N-((o-Nitrophenyl)thio)-L-threonine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting N-((o-Nitrophenyl)thio)-L-threonine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-((o-Nitrophenyl)thio)-L-threonine has 3 hydrogen bond donor(s) and 7 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-((o-Nitrophenyl)thio)-L-threonine?
The CAS number of N-((o-Nitrophenyl)thio)-L-threonine is 7685-70-3.
What is the molecular formula of N-((o-Nitrophenyl)thio)-L-threonine?
The molecular formula of N-((o-Nitrophenyl)thio)-L-threonine is C10H12N2O5S.
What is the molecular weight of N-((o-Nitrophenyl)thio)-L-threonine?
The molecular weight of N-((o-Nitrophenyl)thio)-L-threonine is 272.05 g/mol.
Where can I buy N-((o-Nitrophenyl)thio)-L-threonine?
You can request a quote for N-((o-Nitrophenyl)thio)-L-threonine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((o-Nitrophenyl)thio)-L-threonine?
Yes, KEHONG BIO provides custom synthesis services for N-((o-Nitrophenyl)thio)-L-threonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.