2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0034 |
| Compound Name: | 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C19 H22 F N3 O3 |
| Smiles: | Cc1cn(C)c(CC(N2CCN(CC2)c2ccccc2F)=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0438 |
| logD: | 0.2446 |
| logSw: | -1.942 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.294 |
| InChI Key: | NYUFVZXHAIQXTC-UHFFFAOYSA-N |