3-(2,6-dichloro-3-nitrophenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-(2,6-dichloro-3-nitrophenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
3-(2,6-dichloro-3-nitrophenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 1809-0012 |
| Compound Name: | 3-(2,6-dichloro-3-nitrophenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile |
| Molecular Weight: | 373.2 |
| Molecular Formula: | C17 H10 Cl2 N4 O2 |
| Smiles: | Cc1ccc2c(c1)nc(/C(=C/c1c(ccc(c1[Cl])[N+]([O-])=O)[Cl])C#N)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 4.7573 |
| logD: | 4.7569 |
| logSw: | -5.1 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.395 |
| InChI Key: | GVCJVUNXVPVDAN-UHFFFAOYSA-N |