N-(4-{[(4-ethylphenyl)methyl]carbamoyl}phenyl)-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[(4-ethylphenyl)methyl]carbamoyl}phenyl)-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-{[(4-ethylphenyl)methyl]carbamoyl}phenyl)-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0516 |
| Compound Name: | N-(4-{[(4-ethylphenyl)methyl]carbamoyl}phenyl)-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C27 H26 N4 O3 S |
| Smiles: | CCc1ccc(CNC(c2ccc(cc2)NC(c2nnc(COc3cccc(C)c3)s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1984 |
| logD: | 5.1917 |
| logSw: | -5.0121 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.97 |
| InChI Key: | MQDKVECQKIEVJK-UHFFFAOYSA-N |