4-ethoxy-N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)benzamide
Chemical Structure Depiction of
4-ethoxy-N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)benzamide
4-ethoxy-N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)benzamide
Compound characteristics
| Compound ID: | 4014-2198 |
| Compound Name: | 4-ethoxy-N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)benzamide |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | CCOc1ccc(cc1)C(NC(Nc1ccc(Cc2ccncc2)cc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0879 |
| logD: | 4.0875 |
| logSw: | -4.0069 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.52 |
| InChI Key: | RGYXBZLIHNUCLZ-UHFFFAOYSA-N |