N-[(1H-benzimidazol-2-yl)methyl]-3-(3-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-[(1H-benzimidazol-2-yl)methyl]-3-(3-nitrophenyl)prop-2-enamide
N-[(1H-benzimidazol-2-yl)methyl]-3-(3-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 1682-8468 |
| Compound Name: | N-[(1H-benzimidazol-2-yl)methyl]-3-(3-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 322.32 |
| Molecular Formula: | C17 H14 N4 O3 |
| Smiles: | C(c1nc2ccccc2[nH]1)NC(/C=C/c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2884 |
| logD: | 3.2883 |
| logSw: | -3.5705 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.101 |
| InChI Key: | WBAASOFAXBHLSF-UHFFFAOYSA-N |