N-(4-fluorophenyl)-5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0552 |
| Compound Name: | N-(4-fluorophenyl)-5-({[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C22 H22 F N5 O2 S2 |
| Smiles: | C1CN(CCN1C(CSCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4151 |
| logD: | 3.4124 |
| logSw: | -3.6712 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.71 |
| InChI Key: | MLYXYOQISBMKRJ-UHFFFAOYSA-N |