7-tert-butyl-2-(2,3-dimethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-tert-butyl-2-(2,3-dimethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-tert-butyl-2-(2,3-dimethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0397 |
| Compound Name: | 7-tert-butyl-2-(2,3-dimethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C23 H24 N2 O4 S |
| Smiles: | CC(C)(C)c1cc2CC3=C(N=C(c4cccc(c4OC)OC)NC3=S)Oc2c(c1)O |
| Stereo: | ACHIRAL |
| logP: | 4.9389 |
| logD: | 4.9389 |
| logSw: | -4.3746 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.215 |
| InChI Key: | RPPKKAAHPPAUNM-UHFFFAOYSA-N |