N-(2-methylphenyl)-5-[(4-{[(pyridin-3-yl)methyl]carbamoyl}phenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-[(4-{[(pyridin-3-yl)methyl]carbamoyl}phenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-[(4-{[(pyridin-3-yl)methyl]carbamoyl}phenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L083-0794 |
| Compound Name: | N-(2-methylphenyl)-5-[(4-{[(pyridin-3-yl)methyl]carbamoyl}phenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 459.53 |
| Molecular Formula: | C24 H21 N5 O3 S |
| Smiles: | Cc1ccccc1NC(c1nnc(COc2ccc(cc2)C(NCc2cccnc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5418 |
| logD: | 2.5417 |
| logSw: | -2.3638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.79 |
| InChI Key: | YYLWKNDLAXWJQG-UHFFFAOYSA-N |