7-bromo-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
7-bromo-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
7-bromo-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0068 |
| Compound Name: | 7-bromo-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 355.19 |
| Molecular Formula: | C17 H11 Br N2 O2 |
| Smiles: | C1C2=C(N=C(c3ccccc3)NC2=O)Oc2ccc(cc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.7537 |
| logD: | 3.5955 |
| logSw: | -4.1803 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.717 |
| InChI Key: | DDZQYZMZZJQPHK-UHFFFAOYSA-N |