6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Chemical Structure Depiction of
6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Compound characteristics
| Compound ID: | K511-0010 |
| Compound Name: | 6-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)S(c1ccc2c(c1)C(C(=CN2)C(O)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2813 |
| logD: | -0.396 |
| logSw: | -2.8939 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.956 |
| InChI Key: | ZPSGHLYJHDKUJJ-HNNXBMFYSA-N |