1-[(2,5-dimethylphenyl)methyl]-4-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-4-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
1-[(2,5-dimethylphenyl)methyl]-4-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
Compound ID: | C879-1405 |
Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-4-({[2-(1H-indol-3-yl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
Molecular Weight: | 429.56 |
Molecular Formula: | C27 H31 N3 O2 |
Smiles: | Cc1ccc(C)c(Cn2c(C)c(CNCCc3c[nH]c4ccccc34)c(C(O)=O)c2C)c1 |
Stereo: | ACHIRAL |
logP: | 4.9755 |
logD: | 4.9755 |
logSw: | -4.5679 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 51.822 |
InChI Key: | CUAZVCDSHXXFEL-UHFFFAOYSA-N |