4-({[2-(2-chlorophenyl)ethyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-({[2-(2-chlorophenyl)ethyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
4-({[2-(2-chlorophenyl)ethyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1763 |
| Compound Name: | 4-({[2-(2-chlorophenyl)ethyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 410.94 |
| Molecular Formula: | C24 H27 Cl N2 O2 |
| Smiles: | Cc1cccc(Cn2c(C)c(CNCCc3ccccc3[Cl])c(C(O)=O)c2C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9241 |
| logD: | 4.9241 |
| logSw: | -4.6195 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.951 |
| InChI Key: | NBDBGGRFOLDDNP-UHFFFAOYSA-N |