N-(3-chlorophenyl)-5-[({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0418 |
| Compound Name: | N-(3-chlorophenyl)-5-[({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 446.98 |
| Molecular Formula: | C20 H19 Cl N4 O2 S2 |
| Smiles: | C(CNC(CSCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7619 |
| logD: | 3.7587 |
| logSw: | -4.2863 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.37 |
| InChI Key: | POVCRVXVNLIDLR-UHFFFAOYSA-N |