2-(4-methylbenzamido)-3-(4-nitrophenyl)prop-2-enoic acid
Chemical Structure Depiction of
2-(4-methylbenzamido)-3-(4-nitrophenyl)prop-2-enoic acid
2-(4-methylbenzamido)-3-(4-nitrophenyl)prop-2-enoic acid
Compound characteristics
| Compound ID: | Y070-0103 |
| Compound Name: | 2-(4-methylbenzamido)-3-(4-nitrophenyl)prop-2-enoic acid |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C17 H14 N2 O5 |
| Smiles: | Cc1ccc(cc1)C(NC(=C\c1ccc(cc1)[N+]([O-])=O)\C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8383 |
| logD: | -1.2631 |
| logSw: | -3.4297 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.953 |
| InChI Key: | BYPKLDODFSDYKL-UHFFFAOYSA-N |