4-chloro-N-[2-(4-fluorophenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-[2-(4-fluorophenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
4-chloro-N-[2-(4-fluorophenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 7840-3990 |
| Compound Name: | 4-chloro-N-[2-(4-fluorophenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide |
| Molecular Weight: | 425.8 |
| Molecular Formula: | C20 H13 Cl F N5 O3 |
| Smiles: | Cc1cc2c(cc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)nn(c1ccc(cc1)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.4214 |
| logD: | 3.51 |
| logSw: | -4.6127 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.747 |
| InChI Key: | XTISCHRDALRDIY-UHFFFAOYSA-N |