2-(1H-benzimidazol-2-yl)-3-{5-bromo-2-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-{5-bromo-2-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-{5-bromo-2-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile
Compound characteristics
| Compound ID: | 2038-0236 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-{5-bromo-2-[(propan-2-yl)oxy]phenyl}prop-2-enenitrile |
| Molecular Weight: | 382.26 |
| Molecular Formula: | C19 H16 Br N3 O |
| Smiles: | CC(C)Oc1ccc(cc1/C=C(C#N)/c1nc2ccccc2[nH]1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0127 |
| logD: | 5.0119 |
| logSw: | -4.7413 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.203 |
| InChI Key: | BADFICFQMCZIFC-UHFFFAOYSA-N |