N-[3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(4-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-[3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(4-nitrophenyl)prop-2-enamide
N-[3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(4-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | F269-0090 |
| Compound Name: | N-[3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(4-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 380.36 |
| Molecular Formula: | C18 H16 N6 O4 |
| Smiles: | CC1=CC(NC(=N1)n1c(cc(C)n1)NC(/C=C/c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8146 |
| logD: | 1.2255 |
| logSw: | -2.325 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.804 |
| InChI Key: | MDRIJKBCEBEDGU-UHFFFAOYSA-N |