2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}-N-(4-methylphenyl)acetamide
2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E843-0005 |
| Compound Name: | 2-{7-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-6,8-dioxo-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]quinazolin-5(6H)-yl}-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 449.42 |
| Molecular Formula: | C22 H19 N5 O6 |
| Smiles: | Cc1ccc(cc1)NC(CN1C(N(Cc2nc(C)no2)C(c2cc3c(cc12)OCO3)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0492 |
| logD: | 3.0492 |
| logSw: | -3.4375 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.759 |
| InChI Key: | ASUJTCQAYSLROH-UHFFFAOYSA-N |