3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)quinazoline-2,4(1H,3H)-dione
3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F406-0863 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-7-(3-{4-[(propan-2-yl)oxy]phenyl}-1,2,4-oxadiazol-5-yl)quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 498.49 |
| Molecular Formula: | C27 H22 N4 O6 |
| Smiles: | CC(C)Oc1ccc(cc1)c1nc(c2ccc3C(N(Cc4ccc5c(c4)OCO5)C(Nc3c2)=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.6435 |
| logD: | 5.6434 |
| logSw: | -5.3938 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.804 |
| InChI Key: | BTYGPJVDYVVWGO-UHFFFAOYSA-N |