4-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
4-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3553-1964 |
| Compound Name: | 4-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide |
| Molecular Weight: | 437.84 |
| Molecular Formula: | C21 H16 Cl N5 O4 |
| Smiles: | Cc1cc2c(cc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)nn(c1ccc(cc1)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.3747 |
| logD: | 3.4633 |
| logSw: | -4.6466 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.29 |
| InChI Key: | SMFWBHMPJQWTCE-UHFFFAOYSA-N |