N-(3-chlorophenyl)-5-[(2-{[(2,5-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[(2-{[(2,5-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[(2-{[(2,5-dimethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-1167 |
| Compound Name: | N-(3-chlorophenyl)-5-[(2-{[(2,5-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: | COc1ccc(c(CNC(CSc2nnc(C(Nc3cccc(c3)[Cl])=O)s2)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1081 |
| logD: | 4.1071 |
| logSw: | -4.484 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.569 |
| InChI Key: | YVPYNBNXQLMTAE-UHFFFAOYSA-N |