2-(3,4-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(3,4-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0129 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C20 H18 N2 O4 S |
| Smiles: | COc1ccc(cc1OC)C1NC(C2Cc3cccc(c3OC=2N=1)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 3.4008 |
| logD: | 1.9942 |
| logSw: | -3.8048 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.21 |
| InChI Key: | YEZWQSNWQNZGGZ-UHFFFAOYSA-N |