7-chloro-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-chloro-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-chloro-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0578 |
| Compound Name: | 7-chloro-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 402.85 |
| Molecular Formula: | C19 H15 Cl N2 O4 S |
| Smiles: | COc1cc(cc(c1O)OC)C1NC(C2Cc3cc(ccc3OC=2N=1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 3.4434 |
| logD: | 2.0368 |
| logSw: | -3.9454 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.375 |
| InChI Key: | CJGXJAREYVYYBZ-UHFFFAOYSA-N |