2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(propylsulfanyl)propyl]butanamide
Chemical Structure Depiction of
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(propylsulfanyl)propyl]butanamide
2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(propylsulfanyl)propyl]butanamide
Compound characteristics
| Compound ID: | E005-0849 |
| Compound Name: | 2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)-N-[3-(propylsulfanyl)propyl]butanamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | CCCSCCCNC(C(CC)N1c2ccccc2C2=NC(C=C(C)N12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9138 |
| logD: | 2.9138 |
| logSw: | -3.6392 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.135 |
| InChI Key: | VINGJCSKHBSSNK-KRWDZBQOSA-N |