N-(3-chlorophenyl)-5-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-1164 |
| Compound Name: | N-(3-chlorophenyl)-5-{[2-({[4-(methylsulfanyl)phenyl]methyl}amino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 465.01 |
| Molecular Formula: | C19 H17 Cl N4 O2 S3 |
| Smiles: | CSc1ccc(CNC(CSc2nnc(C(Nc3cccc(c3)[Cl])=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6273 |
| logD: | 4.6264 |
| logSw: | -4.6708 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.395 |
| InChI Key: | VIFDIGHCTLOZKC-UHFFFAOYSA-N |