N-(4-chlorophenyl)-5-[(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-[(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-[(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0568 |
| Compound Name: | N-(4-chlorophenyl)-5-[(2-{[(2,3-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 478.97 |
| Molecular Formula: | C20 H19 Cl N4 O4 S2 |
| Smiles: | COc1cccc(CNC(CSc2nnc(C(Nc3ccc(cc3)[Cl])=O)s2)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.8901 |
| logD: | 3.8893 |
| logSw: | -4.4742 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.742 |
| InChI Key: | ALEOGQYGBJKQGG-UHFFFAOYSA-N |