2-(5-chloro-2-hydroxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(5-chloro-2-hydroxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(5-chloro-2-hydroxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0171 |
| Compound Name: | 2-(5-chloro-2-hydroxyphenyl)-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 386.85 |
| Molecular Formula: | C19 H15 Cl N2 O3 S |
| Smiles: | CCOc1cccc2CC3=C(N=C(c4cc(ccc4O)[Cl])NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 5.1333 |
| logD: | 5.1333 |
| logSw: | -5.1865 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.077 |
| InChI Key: | IVHWEAMDPWLFFN-UHFFFAOYSA-N |