N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide
N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2783-2481 |
| Compound Name: | N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 403.4 |
| Molecular Formula: | C21 H17 N5 O4 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(Nc1ccc2c(c1)nn(c1ccc(cc1)OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6258 |
| logD: | 4.4222 |
| logSw: | -4.558 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.988 |
| InChI Key: | FSENBJCRODKMLT-UHFFFAOYSA-N |