N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]propanamide
Compound characteristics
| Compound ID: | C260-1388 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[1-{2-[cyclohexyl(methyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]propanamide |
| Molecular Weight: | 520.59 |
| Molecular Formula: | C28 H32 N4 O6 |
| Smiles: | CN(C1CCCCC1)C(CN1C(N(CCC(NCc2ccc3c(c2)OCO3)=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5611 |
| logD: | 2.5611 |
| logSw: | -3.2242 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.779 |
| InChI Key: | PIMAYZMJTCECFH-UHFFFAOYSA-N |