2-(4-hydroxy-3,5-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(4-hydroxy-3,5-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(4-hydroxy-3,5-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0574 |
| Compound Name: | 2-(4-hydroxy-3,5-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C20 H18 N2 O5 S |
| Smiles: | COc1cc(cc(c1O)OC)C1NC(C2Cc3cccc(c3OC=2N=1)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 2.7378 |
| logD: | 0.7168 |
| logSw: | -3.2728 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.69 |
| InChI Key: | MGZPXYLLKWDTRT-UHFFFAOYSA-N |