N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide
N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3763-0595 |
| Compound Name: | N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-nitrobenzamide |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C20 H15 N5 O4 |
| Smiles: | COc1ccc(cc1)n1nc2ccc(cc2n1)NC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2033 |
| logD: | 4.1816 |
| logSw: | -4.4636 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.289 |
| InChI Key: | ZJWSSSFNHQOHAA-UHFFFAOYSA-N |