benzyl [3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate
Chemical Structure Depiction of
benzyl [3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate
benzyl [3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate
Compound characteristics
| Compound ID: | C260-1759 |
| Compound Name: | benzyl [3-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate |
| Molecular Weight: | 515.52 |
| Molecular Formula: | C28 H25 N3 O7 |
| Smiles: | C(CN1C(c2ccccc2N(CC(=O)OCc2ccccc2)C1=O)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1261 |
| logD: | 3.1261 |
| logSw: | -3.5947 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.366 |
| InChI Key: | DKWSLSBZTOUQCS-UHFFFAOYSA-N |