N-(3-{[(3-chlorophenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-{[(3-chlorophenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-{[(3-chlorophenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F854-0710 |
| Compound Name: | N-(3-{[(3-chlorophenyl)methyl]carbamoyl}phenyl)-5-(2-methylpropyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 428.94 |
| Molecular Formula: | C21 H21 Cl N4 O2 S |
| Smiles: | CC(C)Cc1nnc(C(Nc2cccc(c2)C(NCc2cccc(c2)[Cl])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.7879 |
| logD: | 4.7878 |
| logSw: | -4.8129 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.742 |
| InChI Key: | JGTPYQZOSOPFHA-UHFFFAOYSA-N |