4-[({3-[ethyl(phenyl)amino]propyl}amino)methyl]-1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-[({3-[ethyl(phenyl)amino]propyl}amino)methyl]-1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
4-[({3-[ethyl(phenyl)amino]propyl}amino)methyl]-1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
Compound ID: | G396-1113 |
Compound Name: | 4-[({3-[ethyl(phenyl)amino]propyl}amino)methyl]-1-[(3-methoxyphenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
Molecular Weight: | 449.59 |
Molecular Formula: | C27 H35 N3 O3 |
Smiles: | CCN(CCCNCc1c(C(O)=O)c(C)n(Cc2cccc(c2)OC)c1C)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 4.2118 |
logD: | 4.2118 |
logSw: | -4.2943 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.485 |
InChI Key: | WYVJSKAIKYAKFD-UHFFFAOYSA-N |