5-{[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0182 |
| Compound Name: | 5-{[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 446.98 |
| Molecular Formula: | C20 H19 Cl N4 O2 S2 |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(CSCC(NCc2ccccc2[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.439 |
| logD: | 4.439 |
| logSw: | -4.3671 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.529 |
| InChI Key: | IKPAEJXTMPKLEK-UHFFFAOYSA-N |