S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine
TL;DR: S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine (CAS 92452-75-0) is a chemical compound with molecular formula C10H19N3O4S and molecular weight 277.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-acetamido-3-[[tert-butyl(nitroso)amino]methylsulfanyl]propanoic acid
Also Known As: FR 900411, S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine, (2R)-2-acetamido-3-[[tert-butyl(nitroso)amino]methylsulfanyl]propanoic acid, (2R)-2-Acetamido-3-9(tert-butyl-nitrosoamino)methylsulfanyl)propanoic acid, S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)-L-cysteine
| Molecular Formula | C10H19N3O4S |
|---|---|
| Molecular Weight | 277.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 277.10962 |
| Heavy Atoms | 18 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 92452-75-0 |
|---|---|
| SMILES | CC(=O)N[C@@H](CSCN(C(C)(C)C)N=O)C(=O)O |
| InChIKey | ABZRGCPWCBDYAR-QMMMGPOBSA-N |
Product Overview
S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine (CAS 92452-75-0), with molecular formula C10H19N3O4S and molecular weight 277.11 g/mol. IUPAC: (2R)-2-acetamido-3-[[tert-butyl(nitroso)amino]methylsulfanyl]propanoic acid.
Chemical Property Profile of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine
Property Insights of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine. Following Lipinski's Rule of Five, S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine has 2 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 S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine?
The CAS number of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine is 92452-75-0.
What is the molecular formula of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine?
The molecular formula of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine is C10H19N3O4S.
What is the molecular weight of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine?
The molecular weight of S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine is 277.11 g/mol.
Where can I buy S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine?
You can request a quote for S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine?
Yes, KEHONG BIO provides custom synthesis services for S-{[tert-Butyl(nitroso)amino]methyl}-N-(1-hydroxyethylidene)cysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.