N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enamide
Chemical Structure Depiction of
N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enamide
N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | 3681-4125 |
| Compound Name: | N-(2-chloro-6-methylphenyl)-2-cyano-3-[5-(4-methyl-2-nitrophenyl)furan-2-yl]prop-2-enamide |
| Molecular Weight: | 421.84 |
| Molecular Formula: | C22 H16 Cl N3 O4 |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)c1ccc(\C=C(/C#N)C(Nc2c(C)cccc2[Cl])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.3577 |
| logD: | 5.2104 |
| logSw: | -5.8977 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.641 |
| InChI Key: | IRQYOSXZMSVPSD-UHFFFAOYSA-N |