2-[3-(2-methylpropoxy)phenyl]-N-[(pyridin-2-yl)carbamothioyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-[3-(2-methylpropoxy)phenyl]-N-[(pyridin-2-yl)carbamothioyl]quinoline-4-carboxamide
2-[3-(2-methylpropoxy)phenyl]-N-[(pyridin-2-yl)carbamothioyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y501-2117 |
| Compound Name: | 2-[3-(2-methylpropoxy)phenyl]-N-[(pyridin-2-yl)carbamothioyl]quinoline-4-carboxamide |
| Molecular Weight: | 456.57 |
| Molecular Formula: | C26 H24 N4 O2 S |
| Smiles: | CC(C)COc1cccc(c1)c1cc(C(NC(Nc2ccccn2)=S)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.5998 |
| logD: | 6.5984 |
| logSw: | -5.9316 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.413 |
| InChI Key: | YKDYVTHKAQGGBZ-UHFFFAOYSA-N |