4-chloro-N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
4-chloro-N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | F019-0660 |
| Compound Name: | 4-chloro-N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-3-nitrobenzamide |
| Molecular Weight: | 472.29 |
| Molecular Formula: | C21 H15 Cl2 N5 O4 |
| Smiles: | Cc1cc2c(cc1NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)nn(c1ccc(c(c1)[Cl])OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.7369 |
| logD: | 3.8255 |
| logSw: | -5.0449 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.377 |
| InChI Key: | SQSUHKCJFGIWTM-UHFFFAOYSA-N |