2-[4-(3-methylphenyl)piperazin-1-yl]-6-pentanamidoquinoline-4-carboxylic acid
Chemical Structure Depiction of
2-[4-(3-methylphenyl)piperazin-1-yl]-6-pentanamidoquinoline-4-carboxylic acid
2-[4-(3-methylphenyl)piperazin-1-yl]-6-pentanamidoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | F724-0221 |
| Compound Name: | 2-[4-(3-methylphenyl)piperazin-1-yl]-6-pentanamidoquinoline-4-carboxylic acid |
| Molecular Weight: | 555.93 |
| Molecular Formula: | C26 H30 N4 O3 |
| Salt: | 3HCl |
| Smiles: | CCCCC(Nc1ccc2c(c1)c(cc(n2)N1CCN(CC1)c1cccc(C)c1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7154 |
| logD: | 2.7713 |
| logSw: | -5.2728 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.303 |
| InChI Key: | FMEIFUDNGICUII-UHFFFAOYSA-N |