2-chloro-N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide
2-chloro-N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8170-0449 |
| Compound Name: | 2-chloro-N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide |
| Molecular Weight: | 411.78 |
| Molecular Formula: | C19 H11 Cl F N5 O3 |
| Smiles: | c1cc2c(cc1NC(c1ccc(cc1[Cl])[N+]([O-])=O)=O)nn(c1ccc(cc1)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.8003 |
| logD: | 4.6402 |
| logSw: | -5.2146 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.745 |
| InChI Key: | YMCILEBRKJLBFO-UHFFFAOYSA-N |