N-{3-[benzyl(propan-2-yl)amino]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
Chemical Structure Depiction of
N-{3-[benzyl(propan-2-yl)amino]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
N-{3-[benzyl(propan-2-yl)amino]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
Compound characteristics
| Compound ID: | E005-0257 |
| Compound Name: | N-{3-[benzyl(propan-2-yl)amino]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C26 H31 N5 O2 |
| Smiles: | CC(C)N(CCCNC(CN1c2ccccc2C2=NC(C=C(C)N12)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4168 |
| logD: | 0.413 |
| logSw: | -3.1348 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.549 |
| InChI Key: | FSHOHAUMKWHXBY-UHFFFAOYSA-N |