1-{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)ethan-1-one
Chemical Structure Depiction of
1-{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)ethan-1-one
1-{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | C762-0322 |
| Compound Name: | 1-{3-[(2-fluorophenyl)methyl]-1,3-diazinan-1-yl}-2-(8-methyl[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)ethan-1-one |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C24 H25 F N4 O2 |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)cnn1CC(N1CCCN(Cc2ccccc2F)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.293 |
| logD: | 3.2602 |
| logSw: | -3.3532 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.579 |
| InChI Key: | WQMGJQCQQDJBPM-UHFFFAOYSA-N |