2-[(butan-2-yl)amino]-9-methyl-3-{[(4-nitrophenyl)imino]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[(butan-2-yl)amino]-9-methyl-3-{[(4-nitrophenyl)imino]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
2-[(butan-2-yl)amino]-9-methyl-3-{[(4-nitrophenyl)imino]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 3341-1624 |
| Compound Name: | 2-[(butan-2-yl)amino]-9-methyl-3-{[(4-nitrophenyl)imino]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 379.42 |
| Molecular Formula: | C20 H21 N5 O3 |
| Smiles: | CCC(C)NC1=C(/C=N/c2ccc(cc2)[N+]([O-])=O)C(N2C=CC=C(C)C2=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9246 |
| logD: | 2.8922 |
| logSw: | -3.3645 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.224 |
| InChI Key: | NBQRUPGHPHWDKT-AWEZNQCLSA-N |