9-methoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
9-methoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
9-methoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0739 |
| Compound Name: | 9-methoxy-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 362.38 |
| Molecular Formula: | C21 H18 N2 O4 |
| Smiles: | COc1cccc2CC3=C(N=C(c4ccc(cc4)OCC=C)NC3=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.579 |
| logD: | 3.4914 |
| logSw: | -3.632 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.449 |
| InChI Key: | PELZCGKFJRODOL-UHFFFAOYSA-N |