N-[2-(4-chlorophenyl)-6-methyl-2H-benzotriazol-5-yl]-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)-6-methyl-2H-benzotriazol-5-yl]-2-methyl-3-nitrobenzamide
N-[2-(4-chlorophenyl)-6-methyl-2H-benzotriazol-5-yl]-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3617-2717 |
| Compound Name: | N-[2-(4-chlorophenyl)-6-methyl-2H-benzotriazol-5-yl]-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 421.84 |
| Molecular Formula: | C21 H16 Cl N5 O3 |
| Smiles: | Cc1cc2c(cc1NC(c1cccc(c1C)[N+]([O-])=O)=O)nn(c1ccc(cc1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 5.0128 |
| logD: | 4.4283 |
| logSw: | -5.119 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.747 |
| InChI Key: | XAENWUWCGJBTQI-UHFFFAOYSA-N |