N-[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
N-[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8377-1136 |
| Compound Name: | N-[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide |
| Molecular Weight: | 484.56 |
| Molecular Formula: | C27 H28 N6 O3 |
| Smiles: | CC1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(Nc1cc2c(cc1C)nn(c1ccc(C)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7124 |
| logD: | 5.35 |
| logSw: | -5.3823 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.898 |
| InChI Key: | GPTDRQLUWHTGAN-UHFFFAOYSA-N |