2-(4-ethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(4-ethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0112 |
| Compound Name: | 2-(4-ethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 366.44 |
| Molecular Formula: | C20 H18 N2 O3 S |
| Smiles: | CCOc1ccc(cc1)C1NC(C2Cc3cccc(c3OC=2N=1)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 4.223 |
| logD: | 4.223 |
| logSw: | -4.3076 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.073 |
| InChI Key: | FZAVTOVVPZRBQA-UHFFFAOYSA-N |