N-{[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Chemical Structure Depiction of
N-{[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
N-{[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 3820-6688 |
| Compound Name: | N-{[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide |
| Molecular Weight: | 391.42 |
| Molecular Formula: | C21 H14 F N3 O2 S |
| Smiles: | c1ccc(cc1)C(NC(Nc1ccc2c(c1)nc(c1ccc(cc1)F)o2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8528 |
| logD: | 4.8521 |
| logSw: | -4.9988 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.05 |
| InChI Key: | VCXYRLFDKIDAGH-UHFFFAOYSA-N |