1-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-3-(prop-2-en-1-yl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-3-(prop-2-en-1-yl)quinazoline-2,4(1H,3H)-dione
1-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-3-(prop-2-en-1-yl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L110-0909 |
| Compound Name: | 1-{[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-3-(prop-2-en-1-yl)quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 404.38 |
| Molecular Formula: | C21 H16 N4 O5 |
| Smiles: | C=CCN1C(c2ccccc2N(Cc2nc(c3ccc4c(c3)OCO4)no2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4379 |
| logD: | 3.4379 |
| logSw: | -3.8661 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.975 |
| InChI Key: | WLMYEVVDMAXPHT-UHFFFAOYSA-N |