N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | C260-1160 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}methyl)benzamide |
| Molecular Weight: | 604.66 |
| Molecular Formula: | C35 H32 N4 O6 |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CN1C(N(Cc2ccc(cc2)C(NCc2ccc3c(c2)OCO3)=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6433 |
| logD: | 4.6433 |
| logSw: | -4.3702 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.549 |
| InChI Key: | IOMHPWARNGMULS-UHFFFAOYSA-N |