N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide
N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide
Compound characteristics
| Compound ID: | 7770-4074 |
| Compound Name: | N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-(morpholin-4-yl)-5-nitrobenzamide |
| Molecular Weight: | 472.5 |
| Molecular Formula: | C25 H24 N6 O4 |
| Smiles: | CCc1ccc(cc1)n1nc2ccc(cc2n1)NC(c1cc(ccc1N1CCOCC1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9768 |
| logD: | 4.6933 |
| logSw: | -4.5275 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.805 |
| InChI Key: | ZIGBSPVFVAUBHB-UHFFFAOYSA-N |