3-(3,4-dimethoxyphenyl)-N-(2-fluoro-5-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-N-(2-fluoro-5-nitrophenyl)prop-2-enamide
3-(3,4-dimethoxyphenyl)-N-(2-fluoro-5-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | Y032-2738 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-N-(2-fluoro-5-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 346.31 |
| Molecular Formula: | C17 H15 F N2 O5 |
| Smiles: | COc1ccc(/C=C/C(Nc2cc(ccc2F)[N+]([O-])=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.7434 |
| logD: | 3.6746 |
| logSw: | -4.1217 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.061 |
| InChI Key: | AREFHUQPYTZSLS-UHFFFAOYSA-N |