2-(3-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(3-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(3-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0124 |
| Compound Name: | 2-(3-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 338.38 |
| Molecular Formula: | C18 H14 N2 O3 S |
| Smiles: | COc1cccc2CC3=C(N=C(c4cccc(c4)O)NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.3836 |
| logD: | 3.3836 |
| logSw: | -3.669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.567 |
| InChI Key: | YXRJBTOIWJBDIL-UHFFFAOYSA-N |