6-butanamido-2-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}quinoline-4-carboxylic acid
Chemical Structure Depiction of
6-butanamido-2-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}quinoline-4-carboxylic acid
6-butanamido-2-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}quinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | F724-0064 |
| Compound Name: | 6-butanamido-2-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}quinoline-4-carboxylic acid |
| Molecular Weight: | 536.88 |
| Molecular Formula: | C22 H29 N5 O4 |
| Salt: | 3HCl |
| Smiles: | CCCC(Nc1ccc2c(c1)c(cc(n2)N1CCN(CC1)CC(N(C)C)=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0212 |
| logD: | -0.9229 |
| logSw: | -2.8587 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.328 |
| InChI Key: | XEUHYLQDFHHQMT-UHFFFAOYSA-N |