7-fluoro-2-[4-(propan-2-yl)phenyl]-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
7-fluoro-2-[4-(propan-2-yl)phenyl]-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
7-fluoro-2-[4-(propan-2-yl)phenyl]-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0613 |
| Compound Name: | 7-fluoro-2-[4-(propan-2-yl)phenyl]-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 336.36 |
| Molecular Formula: | C20 H17 F N2 O2 |
| Smiles: | CC(C)c1ccc(cc1)C1NC(C2Cc3cc(ccc3OC=2N=1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6348 |
| logD: | 4.4413 |
| logSw: | -4.4789 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.717 |
| InChI Key: | LVNQYUDDPVMIEX-UHFFFAOYSA-N |