1-[(2-fluorophenyl)methyl]-2,5-dimethyl-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2-fluorophenyl)methyl]-2,5-dimethyl-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid
1-[(2-fluorophenyl)methyl]-2,5-dimethyl-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-0874 |
| Compound Name: | 1-[(2-fluorophenyl)methyl]-2,5-dimethyl-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 376.47 |
| Molecular Formula: | C21 H29 F N2 O3 |
| Smiles: | CC(C)OCCCNCc1c(C(O)=O)c(C)n(Cc2ccccc2F)c1C |
| Stereo: | ACHIRAL |
| logP: | 2.8945 |
| logD: | 2.8945 |
| logSw: | -3.1774 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.424 |
| InChI Key: | YWVRBFKYDGRPJX-UHFFFAOYSA-N |