9-ethoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
9-ethoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
9-ethoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0675 |
| Compound Name: | 9-ethoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C22 H20 N2 O3 S |
| Smiles: | CCOc1cccc2CC3=C(N=C(c4ccc(cc4)OCC=C)NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.9047 |
| logD: | 4.9047 |
| logSw: | -4.5528 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.947 |
| InChI Key: | MWHJCWJLCXZFSG-UHFFFAOYSA-N |