N-[(2-methoxyphenyl)methyl]-4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide
Chemical Structure Depiction of
N-[(2-methoxyphenyl)methyl]-4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide
N-[(2-methoxyphenyl)methyl]-4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide
Compound characteristics
Compound ID: | C260-1227 |
Compound Name: | N-[(2-methoxyphenyl)methyl]-4-{1-[(3-nitrophenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide |
Molecular Weight: | 502.53 |
Molecular Formula: | C27 H26 N4 O6 |
Smiles: | COc1ccccc1CNC(CCCN1C(c2ccccc2N(Cc2cccc(c2)[N+]([O-])=O)C1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.342 |
logD: | 3.342 |
logSw: | -3.8288 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 96.729 |
InChI Key: | JEWVIJVHNSHJPO-UHFFFAOYSA-N |