7-tert-butyl-2-(4-ethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-tert-butyl-2-(4-ethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-tert-butyl-2-(4-ethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0392 |
| Compound Name: | 7-tert-butyl-2-(4-ethoxyphenyl)-9-hydroxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C23 H24 N2 O3 S |
| Smiles: | CCOc1ccc(cc1)C1NC(C2Cc3cc(cc(c3OC=2N=1)O)C(C)(C)C)=S |
| Stereo: | ACHIRAL |
| logP: | 5.6206 |
| logD: | 5.6206 |
| logSw: | -5.3855 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.991 |
| InChI Key: | LSOULBHACXILMV-UHFFFAOYSA-N |