2-(2,3-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(2,3-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(2,3-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0012 |
| Compound Name: | 2-(2,3-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 352.41 |
| Molecular Formula: | C19 H16 N2 O3 S |
| Smiles: | COc1cccc(C2NC(C3Cc4ccccc4OC=3N=2)=S)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.7085 |
| logD: | 3.7085 |
| logSw: | -4.1677 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.982 |
| InChI Key: | LTKAWUHBTWHJCA-UHFFFAOYSA-N |