5-(4-{[(2-chlorophenyl)methyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[(2-chlorophenyl)methyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(4-{[(2-chlorophenyl)methyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0591 |
| Compound Name: | 5-(4-{[(2-chlorophenyl)methyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 414.91 |
| Molecular Formula: | C20 H19 Cl N4 O2 S |
| Smiles: | C(CC(NCc1ccccc1[Cl])=O)Cc1nnc(C(Nc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.42 |
| logD: | 3.42 |
| logSw: | -3.7315 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.529 |
| InChI Key: | VFBAGUGBHHNZLC-UHFFFAOYSA-N |