2-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-6-(2-methoxyacetamido)quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Chemical Structure Depiction of
2-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-6-(2-methoxyacetamido)quinoline-4-carboxylic acid--hydrogen chloride (1/3)
2-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-6-(2-methoxyacetamido)quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Compound characteristics
| Compound ID: | F724-0325 |
| Compound Name: | 2-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-6-(2-methoxyacetamido)quinoline-4-carboxylic acid--hydrogen chloride (1/3) |
| Molecular Weight: | 566.91 |
| Molecular Formula: | C23 H31 N5 O5 |
| Salt: | 3HCl |
| Smiles: | CCCCNC(CN1CCN(CC1)c1cc(C(O)=O)c2cc(ccc2n1)NC(COC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8882 |
| logD: | -0.0559 |
| logSw: | -3.1755 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.591 |
| InChI Key: | CFBUQCDYDCUZCR-UHFFFAOYSA-N |