N-[(4-ethoxyphenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
N-[(4-ethoxyphenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y501-2908 |
| Compound Name: | N-[(4-ethoxyphenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C25 H21 N3 O2 S |
| Smiles: | CCOc1ccc(cc1)NC(NC(c1cc(c2ccccc2)nc2ccccc12)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.2017 |
| logD: | 6.2016 |
| logSw: | -5.7263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.423 |
| InChI Key: | GISYJOYSHMNQAJ-UHFFFAOYSA-N |