N-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-benzoylbenzamide
Chemical Structure Depiction of
N-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-benzoylbenzamide
N-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-benzoylbenzamide
Compound characteristics
| Compound ID: | 3343-0283 |
| Compound Name: | N-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-benzoylbenzamide |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C28 H19 N3 O3 S |
| Smiles: | c1ccc(cc1)C(c1ccc(cc1)C(NC(Nc1ccc(cc1)c1nc2ccccc2o1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0617 |
| logD: | 6.0608 |
| logSw: | -6.175 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.517 |
| InChI Key: | JYLGWOHRAAOSLM-UHFFFAOYSA-N |