ethyl {3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(cyclohexylcarbamoyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetate
Chemical Structure Depiction of
ethyl {3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(cyclohexylcarbamoyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetate
ethyl {3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(cyclohexylcarbamoyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetate
Compound characteristics
| Compound ID: | C487-0383 |
| Compound Name: | ethyl {3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(cyclohexylcarbamoyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl}acetate |
| Molecular Weight: | 507.54 |
| Molecular Formula: | C27 H29 N3 O7 |
| Smiles: | CCOC(CN1C(N(Cc2ccc3c(c2)OCO3)C(c2ccc(cc12)C(NC1CCCCC1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8906 |
| logD: | 3.8906 |
| logSw: | -3.9957 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.951 |
| InChI Key: | RNHLGUJWPSFRFZ-UHFFFAOYSA-N |