2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid
2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0137 |
| Compound Name: | 2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-[({3-[(propan-2-yl)oxy]propyl}amino)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 372.51 |
| Molecular Formula: | C22 H32 N2 O3 |
| Smiles: | CC(C)OCCCNCc1c(C(O)=O)c(C)n(Cc2cccc(C)c2)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.2631 |
| logD: | 3.2631 |
| logSw: | -3.3475 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.424 |
| InChI Key: | RDXKYXHVVUDXJJ-UHFFFAOYSA-N |