2-(1H-benzimidazol-2-yl)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 8007-0085 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]prop-2-enenitrile |
| Molecular Weight: | 390.78 |
| Molecular Formula: | C20 H11 Cl N4 O3 |
| Smiles: | C(=C(C#N)/c1nc2ccccc2[nH]1)\c1ccc(c2ccc(c(c2)[N+]([O-])=O)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.9615 |
| logD: | 4.9609 |
| logSw: | -5.4157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.965 |
| InChI Key: | RRDRNNAKPVQWBC-UHFFFAOYSA-N |