2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
Chemical Structure Depiction of
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
Compound characteristics
| Compound ID: | E005-0660 |
| Compound Name: | 2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(trifluoromethyl)phenyl]butanamide |
| Molecular Weight: | 428.41 |
| Molecular Formula: | C22 H19 F3 N4 O2 |
| Smiles: | CCC(C(Nc1cccc(c1)C(F)(F)F)=O)N1c2ccccc2C2=NC(C=C(C)N12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2083 |
| logD: | 4.2075 |
| logSw: | -4.3427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.7 |
| InChI Key: | OYCHYNNKGYJLMX-KRWDZBQOSA-N |