2-acetamido-3-(2H-1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
2-acetamido-3-(2H-1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)prop-2-enamide
2-acetamido-3-(2H-1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 3633-0082 |
| Compound Name: | 2-acetamido-3-(2H-1,3-benzodioxol-5-yl)-N-(4-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 369.33 |
| Molecular Formula: | C18 H15 N3 O6 |
| Smiles: | CC(NC(=C\c1ccc2c(c1)OCO2)\C(Nc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.534 |
| logD: | 1.4335 |
| logSw: | -3.0464 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.922 |
| InChI Key: | GZMWNSCXTPJXHQ-UHFFFAOYSA-N |