2-cyano-N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)prop-2-enamide
2-cyano-N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | Y505-4699 |
| Compound Name: | 2-cyano-N-(4-methyl-2-nitrophenyl)-3-(4-methylphenyl)prop-2-enamide |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C18 H15 N3 O3 |
| Smiles: | Cc1ccc(\C=C(/C#N)C(Nc2ccc(C)cc2[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4582 |
| logD: | 3.0054 |
| logSw: | -4.4263 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.769 |
| InChI Key: | LJQYUAOOVRHZQR-UHFFFAOYSA-N |