5-({[2-(benzylamino)-2-oxoethyl]sulfanyl}methyl)-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({[2-(benzylamino)-2-oxoethyl]sulfanyl}methyl)-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-({[2-(benzylamino)-2-oxoethyl]sulfanyl}methyl)-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0519 |
| Compound Name: | 5-({[2-(benzylamino)-2-oxoethyl]sulfanyl}methyl)-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C19 H17 F N4 O2 S2 |
| Smiles: | C(c1ccccc1)NC(CSCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2627 |
| logD: | 3.26 |
| logSw: | -3.5117 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.529 |
| InChI Key: | XSCLBNYZGBBGSK-UHFFFAOYSA-N |