7-chloro-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-chloro-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-chloro-2-(3-ethoxy-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0070 |
| Compound Name: | 7-chloro-2-(3-ethoxy-2-hydroxyphenyl)-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: | CCOc1cccc(C2NC(C3Cc4cc(ccc4OC=3N=2)[Cl])=S)c1O |
| Stereo: | ACHIRAL |
| logP: | 4.5749 |
| logD: | 4.5749 |
| logSw: | -4.5564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.324 |
| InChI Key: | CBLUPAUYJLWFMT-UHFFFAOYSA-N |