2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-9-[(4-nitrophenyl)methoxy]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-9-[(4-nitrophenyl)methoxy]-4H-pyrido[1,2-a]pyrimidin-4-one
2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-9-[(4-nitrophenyl)methoxy]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | V003-1411 |
| Compound Name: | 2-methyl-3-[5-methyl-1-(3-methylphenyl)-1H-pyrazol-3-yl]-9-[(4-nitrophenyl)methoxy]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 481.51 |
| Molecular Formula: | C27 H23 N5 O4 |
| Smiles: | CC1=C(C(N2C=CC=C(C2=N1)OCc1ccc(cc1)[N+]([O-])=O)=O)c1cc(C)n(c2cccc(C)c2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5438 |
| logD: | 4.5405 |
| logSw: | -4.6413 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.25 |
| InChI Key: | XRDAEBWIIRJCBV-UHFFFAOYSA-N |