1-[(4-chlorophenyl)methyl]-2,5-dimethyl-4-({[(3-methylphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-2,5-dimethyl-4-({[(3-methylphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
1-[(4-chlorophenyl)methyl]-2,5-dimethyl-4-({[(3-methylphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-2204 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-2,5-dimethyl-4-({[(3-methylphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 396.92 |
| Molecular Formula: | C23 H25 Cl N2 O2 |
| Smiles: | Cc1cccc(CNCc2c(C(O)=O)c(C)n(Cc3ccc(cc3)[Cl])c2C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8958 |
| logD: | 4.8958 |
| logSw: | -4.7609 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.11 |
| InChI Key: | GLNSHMCAKKGRMM-UHFFFAOYSA-N |