2-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid
Chemical Structure Depiction of
2-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid
2-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | F724-0237 |
| Compound Name: | 2-{4-[(2-fluorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid |
| Molecular Weight: | 573.92 |
| Molecular Formula: | C26 H29 F N4 O3 |
| Salt: | 3HCl |
| Smiles: | CCCCC(Nc1ccc2c(c1)c(cc(n2)N1CCN(CC1)Cc1ccccc1F)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2483 |
| logD: | 2.3042 |
| logSw: | -4.9108 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.583 |
| InChI Key: | NWIGICAVWMTMLD-UHFFFAOYSA-N |