2-(1H-benzimidazol-2-yl)-3-(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 8018-1270 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)prop-2-enenitrile |
| Molecular Weight: | 463.13 |
| Molecular Formula: | C18 H13 Br2 N3 O2 |
| Smiles: | CCOc1cc(/C=C(C#N)/c2nc3ccccc3[nH]2)c(c(c1O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8801 |
| logD: | 4.6716 |
| logSw: | -4.395 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.004 |
| InChI Key: | ADTDRMLVNRRCHU-UHFFFAOYSA-N |