benzyl [3-(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate
Chemical Structure Depiction of
benzyl [3-(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate
benzyl [3-(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate
Compound characteristics
| Compound ID: | C260-1855 |
| Compound Name: | benzyl [3-(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetate |
| Molecular Weight: | 559.62 |
| Molecular Formula: | C31 H33 N3 O7 |
| Smiles: | COc1ccc(CCNC(CCCN2C(c3ccccc3N(CC(=O)OCc3ccccc3)C2=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.2515 |
| logD: | 2.2515 |
| logSw: | -3.1443 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.353 |
| InChI Key: | LROMMZDHUYGCFU-UHFFFAOYSA-N |