methyl 2-({2-oxo-2-[(2-oxothiolan-3-yl)amino]ethyl}sulfanyl)benzoate
Chemical Structure Depiction of
methyl 2-({2-oxo-2-[(2-oxothiolan-3-yl)amino]ethyl}sulfanyl)benzoate
methyl 2-({2-oxo-2-[(2-oxothiolan-3-yl)amino]ethyl}sulfanyl)benzoate
Compound characteristics
| Compound ID: | 8019-8757 |
| Compound Name: | methyl 2-({2-oxo-2-[(2-oxothiolan-3-yl)amino]ethyl}sulfanyl)benzoate |
| Molecular Weight: | 325.4 |
| Molecular Formula: | C14 H15 N O4 S2 |
| Smiles: | COC(c1ccccc1SCC(NC1CCSC1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3554 |
| logD: | 1.3128 |
| logSw: | -2.0802 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.166 |
| InChI Key: | IRVAHPJTCCMJDB-SNVBAGLBSA-N |