5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0727 |
| Compound Name: | 5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C22 H23 N5 O2 S2 |
| Smiles: | C1CN(CCN1C(CSCc1nnc(C(Nc2ccccc2)=O)s1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1943 |
| logD: | 3.1943 |
| logSw: | -3.4256 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.71 |
| InChI Key: | XLPABRREQVIQRD-UHFFFAOYSA-N |