5-{[(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{[(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0681 |
| Compound Name: | 5-{[(2-{[(3-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 432.95 |
| Molecular Formula: | C19 H17 Cl N4 O2 S2 |
| Smiles: | C(c1cccc(c1)[Cl])NC(CSCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7393 |
| logD: | 3.7392 |
| logSw: | -4.2456 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.529 |
| InChI Key: | VNXFALPYHSEZTA-UHFFFAOYSA-N |