N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide
Chemical Structure Depiction of
N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide
N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide
Compound characteristics
| Compound ID: | C227-0046 |
| Compound Name: | N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide |
| Molecular Weight: | 530.63 |
| Molecular Formula: | C29 H34 N6 O4 |
| Smiles: | Cc1cc(nc2ccc(cc12)NC(CCC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7624 |
| logD: | 4.762 |
| logSw: | -4.6007 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.397 |
| InChI Key: | WFIAONQEJBMYJO-UHFFFAOYSA-N |