N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide
Compound characteristics
| Compound ID: | E005-0228 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6(2H)-yl)acetamide |
| Molecular Weight: | 488.59 |
| Molecular Formula: | C27 H32 N6 O3 |
| Smiles: | CC1=CC(N=C2c3ccccc3N(CC(NCCCN3CCN(CC3)c3ccc(cc3)OC)=O)N12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6791 |
| logD: | 1.093 |
| logSw: | -2.7347 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.738 |
| InChI Key: | VRUPQKNKYAMJDS-UHFFFAOYSA-N |