methyl 4-[3-(2-nitrophenyl)prop-2-enamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(2-nitrophenyl)prop-2-enamido]benzoate
methyl 4-[3-(2-nitrophenyl)prop-2-enamido]benzoate
Compound characteristics
| Compound ID: | Y032-3114 |
| Compound Name: | methyl 4-[3-(2-nitrophenyl)prop-2-enamido]benzoate |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C17 H14 N2 O5 |
| Smiles: | COC(c1ccc(cc1)NC(/C=C/c1ccccc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4896 |
| logD: | 3.4894 |
| logSw: | -3.8068 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.371 |
| InChI Key: | YWFHVYBJOAZLMS-UHFFFAOYSA-N |