1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-({[2-(2-methylphenyl)ethyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-({[2-(2-methylphenyl)ethyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-({[2-(2-methylphenyl)ethyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-2047 |
| Compound Name: | 1-[(2-chloro-6-fluorophenyl)methyl]-2,5-dimethyl-4-({[2-(2-methylphenyl)ethyl]amino}methyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 428.93 |
| Molecular Formula: | C24 H26 Cl F N2 O2 |
| Smiles: | Cc1ccccc1CCNCc1c(C(O)=O)c(C)n(Cc2c(cccc2[Cl])F)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.0063 |
| logD: | 5.0063 |
| logSw: | -4.7789 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.951 |
| InChI Key: | CNHPXQYCOJLYIN-UHFFFAOYSA-N |