N-(4-chlorophenyl)-5-[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0589 |
| Compound Name: | N-(4-chlorophenyl)-5-[(2-{[(4-ethylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 446.98 |
| Molecular Formula: | C20 H19 Cl N4 O2 S2 |
| Smiles: | CCc1ccc(CNC(CSc2nnc(C(Nc3ccc(cc3)[Cl])=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6798 |
| logD: | 4.679 |
| logSw: | -4.7324 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.395 |
| InChI Key: | XDJWTHYCTUITQQ-UHFFFAOYSA-N |