4-[({3-[benzyl(ethyl)amino]propyl}amino)methyl]-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-[({3-[benzyl(ethyl)amino]propyl}amino)methyl]-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
4-[({3-[benzyl(ethyl)amino]propyl}amino)methyl]-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-1805 |
| Compound Name: | 4-[({3-[benzyl(ethyl)amino]propyl}amino)methyl]-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 454.01 |
| Molecular Formula: | C26 H32 Cl N3 O2 |
| Smiles: | CCN(CCCNCc1c(C(O)=O)c(C)n(c2ccc(cc2)[Cl])c1C)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2335 |
| logD: | 4.2335 |
| logSw: | -4.4802 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.381 |
| InChI Key: | BAPAKLHVIQETSN-UHFFFAOYSA-N |