2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0028 |
| Compound Name: | 2-(4-ethylphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C19 H16 N2 O S |
| Smiles: | CCc1ccc(cc1)C1NC(C2Cc3ccccc3OC=2N=1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.9519 |
| logD: | 4.9519 |
| logSw: | -4.7016 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.6349 |
| InChI Key: | JJLKRUGPZZKHBZ-UHFFFAOYSA-N |