S-Nitrosohomocysteine
TL;DR: S-Nitrosohomocysteine (CAS 139427-42-2) is a chemical compound with molecular formula C4H8N2O3S and molecular weight 164.02556 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nitroso (2S)-2-amino-4-sulfanylbutanoate
Also Known As: S-Nitrosohomocysteine, nitroso (2S)-2-amino-4-sulfanylbutanoate, L-Homocysteine, nitrite (ester), 2-Amino-4-sulfanylbutanoyl nitrite, (2S)-2-Amino-4-sulfanylbutanoyl nitrite
Technical Specifications
| Molecular Formula | C4H8N2O3S |
| Molecular Weight | 164.02556 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 82.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 164.02556 Da |
| Heavy Atoms | 10 |
| Complexity | 130.0 |
| SMILES | C(CS)[C@@H](C(=O)ON=O)N |
| InChIKey | MSECJJDPRYTQLG-VKHMYHEASA-N |
Chemical Property Profile of S-Nitrosohomocysteine
Property Insights of S-Nitrosohomocysteine
The XLogP value of -0.4 indicates that S-Nitrosohomocysteine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for S-Nitrosohomocysteine. Following Lipinski's Rule of Five, S-Nitrosohomocysteine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of S-Nitrosohomocysteine?
The CAS number of S-Nitrosohomocysteine is 139427-42-2.
What is the molecular formula of S-Nitrosohomocysteine?
The molecular formula of S-Nitrosohomocysteine is C4H8N2O3S.
What is the molecular weight of S-Nitrosohomocysteine?
The molecular weight of S-Nitrosohomocysteine is 164.02556 g/mol.
Where can I buy S-Nitrosohomocysteine?
You can request a quote for S-Nitrosohomocysteine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for S-Nitrosohomocysteine?
Yes, CoreyChem provides custom synthesis services for S-Nitrosohomocysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.