N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-ethyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-ethyl-1,3,4-thiadiazole-2-carboxamide
N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-ethyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F854-0019 |
| Compound Name: | N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-ethyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 400.88 |
| Molecular Formula: | C19 H17 Cl N4 O2 S |
| Smiles: | CCc1nnc(C(Nc2cccc(c2)C(NCc2ccc(cc2)[Cl])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8363 |
| logD: | 3.8362 |
| logSw: | -4.3306 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.742 |
| InChI Key: | BXPOEAJRELLHTB-UHFFFAOYSA-N |