3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | K221-3467 |
Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione |
Molecular Weight: | 514.54 |
Molecular Formula: | C28 H26 N4 O6 |
Smiles: | COc1ccccc1N1CCN(CC1)C(c1ccc2C(N(Cc3ccc4c(c3)OCO4)C(Nc2c1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4992 |
logD: | 3.4991 |
logSw: | -3.6927 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.834 |
InChI Key: | FVXHYLYYZWGIBE-UHFFFAOYSA-N |