N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide
N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide
Compound characteristics
| Compound ID: | 7770-4080 |
| Compound Name: | N-[2-(4-fluorophenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide |
| Molecular Weight: | 462.44 |
| Molecular Formula: | C23 H19 F N6 O4 |
| Smiles: | C1COCCN1c1ccc(cc1C(Nc1ccc2c(c1)nn(c1ccc(cc1)F)n2)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0752 |
| logD: | 3.7917 |
| logSw: | -4.2602 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.805 |
| InChI Key: | LQHZLWNHVYVKBK-UHFFFAOYSA-N |