N-{[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Chemical Structure Depiction of
N-{[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
N-{[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 3149-0271 |
| Compound Name: | N-{[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide |
| Molecular Weight: | 391.42 |
| Molecular Formula: | C20 H14 F N5 O S |
| Smiles: | c1ccc(cc1)C(NC(Nc1ccc2c(c1)nn(c1ccc(cc1)F)n2)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6016 |
| logD: | 4.6008 |
| logSw: | -4.4899 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.274 |
| InChI Key: | JZNGBTMLBDXTDZ-UHFFFAOYSA-N |