3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L927-0282 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-{[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 490.49 |
| Molecular Formula: | C24 H18 N4 O6 S |
| Smiles: | COc1ccccc1c1nc(CN2C(N(Cc3ccc4c(c3)OCO4)C(c3c2ccs3)=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.3386 |
| logD: | 4.3386 |
| logSw: | -4.4822 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.374 |
| InChI Key: | RZICCRQHAMBZLL-UHFFFAOYSA-N |