4-[({2-[benzyl(methyl)amino]ethyl}amino)methyl]-1-[(4-chlorophenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-[({2-[benzyl(methyl)amino]ethyl}amino)methyl]-1-[(4-chlorophenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
4-[({2-[benzyl(methyl)amino]ethyl}amino)methyl]-1-[(4-chlorophenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0637 |
| Compound Name: | 4-[({2-[benzyl(methyl)amino]ethyl}amino)methyl]-1-[(4-chlorophenyl)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 439.98 |
| Molecular Formula: | C25 H30 Cl N3 O2 |
| Smiles: | Cc1c(CNCCN(C)Cc2ccccc2)c(C(O)=O)c(C)n1Cc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0412 |
| logD: | 4.0412 |
| logSw: | -4.4998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.046 |
| InChI Key: | CEHPRUSNLGLTOV-UHFFFAOYSA-N |