N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | C260-1156 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide |
| Molecular Weight: | 601.62 |
| Molecular Formula: | C34 H27 N5 O6 |
| Smiles: | CC1=CC=CC2=NC(CN3C(N(Cc4ccc(cc4)C(NCc4ccc5c(c4)OCO5)=O)C(c4ccccc34)=O)=O)=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2997 |
| logD: | 3.2997 |
| logSw: | -3.8256 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.447 |
| InChI Key: | QEAFWQJDASCQNL-UHFFFAOYSA-N |