1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(2-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(2-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(2-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
Compound ID: | C879-1301 |
Compound Name: | 1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-{[(2-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid |
Molecular Weight: | 428.93 |
Molecular Formula: | C24 H26 Cl F N2 O2 |
Smiles: | CC(CNCc1c(C(O)=O)c(C)n(Cc2c(cccc2[Cl])F)c1C)c1ccccc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3983 |
logD: | 5.3983 |
logSw: | -5.6938 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 42.11 |
InChI Key: | AMNQGMUHFXFKTC-HNNXBMFYSA-N |