2-cyano-3-{3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-{3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}prop-2-enamide
2-cyano-3-{3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}prop-2-enamide
Compound characteristics
| Compound ID: | Y510-5104 |
| Compound Name: | 2-cyano-3-{3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}prop-2-enamide |
| Molecular Weight: | 353.33 |
| Molecular Formula: | C18 H15 N3 O5 |
| Smiles: | COc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3371 |
| logD: | 2.3371 |
| logSw: | -2.7339 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.68 |
| InChI Key: | MFGQTROBLIMHCZ-UHFFFAOYSA-N |