N-[(3-hydroxyphenyl)carbamothioyl]-2-{3-[(propan-2-yl)oxy]phenyl}quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(3-hydroxyphenyl)carbamothioyl]-2-{3-[(propan-2-yl)oxy]phenyl}quinoline-4-carboxamide
N-[(3-hydroxyphenyl)carbamothioyl]-2-{3-[(propan-2-yl)oxy]phenyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y501-0298 |
| Compound Name: | N-[(3-hydroxyphenyl)carbamothioyl]-2-{3-[(propan-2-yl)oxy]phenyl}quinoline-4-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C26 H23 N3 O3 S |
| Smiles: | CC(C)Oc1cccc(c1)c1cc(C(NC(Nc2cccc(c2)O)=S)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8924 |
| logD: | 5.8919 |
| logSw: | -5.4646 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.719 |
| InChI Key: | FGLXEZIETVXVEP-UHFFFAOYSA-N |