N-{1-(4-methoxyphenyl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{1-(4-methoxyphenyl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-nitrobenzamide
N-{1-(4-methoxyphenyl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1502-1384 |
| Compound Name: | N-{1-(4-methoxyphenyl)-3-oxo-3-[(prop-2-en-1-yl)amino]prop-1-en-2-yl}-4-nitrobenzamide |
| Molecular Weight: | 381.39 |
| Molecular Formula: | C20 H19 N3 O5 |
| Smiles: | COc1ccc(\C=C(/C(NCC=C)=O)NC(c2ccc(cc2)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6858 |
| logD: | 1.4553 |
| logSw: | -3.1656 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.615 |
| InChI Key: | HGQVUXRAXFCGDK-UHFFFAOYSA-N |