2-(2,3-dimethoxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(2,3-dimethoxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(2,3-dimethoxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0152 |
| Compound Name: | 2-(2,3-dimethoxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C21 H20 N2 O4 S |
| Smiles: | CCOc1cccc2CC3=C(N=C(c4cccc(c4OC)OC)NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.0588 |
| logD: | 4.0588 |
| logSw: | -4.2991 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.877 |
| InChI Key: | MIDBMGOLYFSLCZ-UHFFFAOYSA-N |