7-methyl-2-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
7-methyl-2-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
7-methyl-2-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0748 |
| Compound Name: | 7-methyl-2-{3-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 346.38 |
| Molecular Formula: | C21 H18 N2 O3 |
| Smiles: | Cc1ccc2c(CC3=C(N=C(c4cccc(c4)OCC=C)NC3=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.034 |
| logD: | 3.9865 |
| logSw: | -4.1513 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.134 |
| InChI Key: | YIGBWPWXDHCLKW-UHFFFAOYSA-N |