2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-(2,3,5,6-tetrafluorophenyl)butanamide
Chemical Structure Depiction of
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-(2,3,5,6-tetrafluorophenyl)butanamide
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-(2,3,5,6-tetrafluorophenyl)butanamide
Compound characteristics
| Compound ID: | E005-0803 |
| Compound Name: | 2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-(2,3,5,6-tetrafluorophenyl)butanamide |
| Molecular Weight: | 432.38 |
| Molecular Formula: | C21 H16 F4 N4 O2 |
| Smiles: | CCC(C(Nc1c(c(cc(c1F)F)F)F)=O)N1c2ccccc2C2=NC(C=C(C)N12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5509 |
| logD: | 1.181 |
| logSw: | -3.933 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.304 |
| InChI Key: | QVDMXXYHMVWMFA-AWEZNQCLSA-N |