2-(2-hydroxy-3-methoxyphenyl)-9-methyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(2-hydroxy-3-methoxyphenyl)-9-methyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(2-hydroxy-3-methoxyphenyl)-9-methyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0240 |
| Compound Name: | 2-(2-hydroxy-3-methoxyphenyl)-9-methyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 352.41 |
| Molecular Formula: | C19 H16 N2 O3 S |
| Smiles: | Cc1cccc2CC3=C(N=C(c4cccc(c4O)OC)NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.0654 |
| logD: | 4.0654 |
| logSw: | -4.2992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.429 |
| InChI Key: | LLNCOENJPWBRSX-UHFFFAOYSA-N |