5-[1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(3-methylbutyl)pentanamide
Chemical Structure Depiction of
5-[1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(3-methylbutyl)pentanamide
5-[1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(3-methylbutyl)pentanamide
Compound characteristics
| Compound ID: | F142-0175 |
| Compound Name: | 5-[1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(3-methylbutyl)pentanamide |
| Molecular Weight: | 508.57 |
| Molecular Formula: | C27 H32 N4 O6 |
| Smiles: | CC(C)CCNC(CCCCN1C(c2ccccc2N(CC(Nc2ccc3c(c2)OCO3)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8794 |
| logD: | 2.8793 |
| logSw: | -3.5662 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.095 |
| InChI Key: | FUGKJEMQEZFDPC-UHFFFAOYSA-N |