3-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
3-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D390-0789 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 362.41 |
| Molecular Formula: | C20 H14 N2 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)N1C=Nc2c(C1=O)c(cs2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6225 |
| logD: | 3.6225 |
| logSw: | -3.9919 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.085 |
| InChI Key: | XGEWZNHVJZDXHT-UHFFFAOYSA-N |