N-(4-chloro-2-nitrophenyl)-2-cyano-3-(2,5-dimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-(4-chloro-2-nitrophenyl)-2-cyano-3-(2,5-dimethoxyphenyl)prop-2-enamide
N-(4-chloro-2-nitrophenyl)-2-cyano-3-(2,5-dimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | Y511-8801 |
| Compound Name: | N-(4-chloro-2-nitrophenyl)-2-cyano-3-(2,5-dimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 387.78 |
| Molecular Formula: | C18 H14 Cl N3 O5 |
| Smiles: | COc1ccc(c(\C=C(/C#N)C(Nc2ccc(cc2[N+]([O-])=O)[Cl])=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.219 |
| logD: | 1.41 |
| logSw: | -4.733 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.94 |
| InChI Key: | YDPXHJBMOCHJSN-UHFFFAOYSA-N |