2-[4-(3-chlorophenyl)piperazin-1-yl]-6-(3-methylbutanamido)quinoline-4-carboxylic acid
Chemical Structure Depiction of
2-[4-(3-chlorophenyl)piperazin-1-yl]-6-(3-methylbutanamido)quinoline-4-carboxylic acid
2-[4-(3-chlorophenyl)piperazin-1-yl]-6-(3-methylbutanamido)quinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | F724-0245 |
| Compound Name: | 2-[4-(3-chlorophenyl)piperazin-1-yl]-6-(3-methylbutanamido)quinoline-4-carboxylic acid |
| Molecular Weight: | 576.35 |
| Molecular Formula: | C25 H27 Cl N4 O3 |
| Salt: | 3HCl |
| Smiles: | CC(C)CC(Nc1ccc2c(c1)c(cc(n2)N1CCN(CC1)c1cccc(c1)[Cl])C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9661 |
| logD: | 3.022 |
| logSw: | -5.7028 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.303 |
| InChI Key: | YWYHYJAKAJZMAX-UHFFFAOYSA-N |