I-152
S-[2-[[(2R)-2-acetamido-3-sulfanylpropanoyl]amino]ethyl] ethanethioate
Also Known As: I-152|I 152|I152|J1.536.973F|s-{2-[(n-acetyl-l-cysteinyl)amino]ethyl} ethanethioate|Ethanethioic acid, S-(2-(((2R)-2-(acetylamino)-3-mercapto-1-oxopropyl)amino)ethyl)ester|N-(N-ACETYL-L-CYSTEINYL)-S-ACETYLCYSTEAMINE|N-[2-(Acetylthio)ethyl]-Nalpha-acetyl-L-cysteinamide|(R)-S-(2-(2-ACETAMIDO-3-MERCAPTOPROPANAMIDO)ETHYL) ETHANETHIOATE|S-[2-[[(2R)-2-acetamido-3-sulfanylpropanoyl]amino]ethyl] ethanethioate|(2R)-N-[2-(ACETYLSULFANYL)ETHYL]-2-ACETAMIDO-3-SULFANYLPROPANAMIDE|S-[2-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]ethyl] ethanethioate|Ethanethioic acid, S-[2-[[(2R)-2-(acetylamino)-3-mercapto-1-oxopropyl]amino]ethyl]ester|Ethanethioic acid,S-[2-[[(2R)-2-(acetylamino)-3-mercapto-1-oxopropyl]amino]ethyl] ester
| Molecular Formula | C9H16N2O3S2 |
|---|---|
| Molecular Weight | 264.06024 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.06024 |
| Monoisotopic Mass | 264.06024 |
| Heavy Atoms | 16 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 31335-50-9 |
|---|---|
| SMILES | CC(=O)N[C@@H](CS)C(=O)NCCSC(=O)C |
| InChIKey | PCFWUYJHCYCQKP-QMMMGPOBSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
I-152 (CAS 31335-50-9), with molecular formula C9H16N2O3S2 and molecular weight 264.06024 g/mol. IUPAC: S-[2-[[(2R)-2-acetamido-3-sulfanylpropanoyl]amino]ethyl] ethanethioate.