1-[(2-chloro-4-fluorophenyl)methyl]-4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
1-[(2-chloro-4-fluorophenyl)methyl]-4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1070 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 390.84 |
| Molecular Formula: | C20 H20 Cl F N2 O3 |
| Smiles: | Cc1c(CNCc2ccco2)c(C(O)=O)c(C)n1Cc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.0165 |
| logD: | 4.0165 |
| logSw: | -4.2493 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.859 |
| InChI Key: | VFSUZLRZKCKWBR-UHFFFAOYSA-N |