1-[(3-chlorophenyl)methyl]-4-({[2-(2,4-dimethoxyphenyl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-4-({[2-(2,4-dimethoxyphenyl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
1-[(3-chlorophenyl)methyl]-4-({[2-(2,4-dimethoxyphenyl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1572 |
| Compound Name: | 1-[(3-chlorophenyl)methyl]-4-({[2-(2,4-dimethoxyphenyl)ethyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C25 H29 Cl N2 O4 |
| Smiles: | Cc1c(CNCCc2ccc(cc2OC)OC)c(C(O)=O)c(C)n1Cc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3801 |
| logD: | 4.3801 |
| logSw: | -4.5257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.125 |
| InChI Key: | VBJPNVKSDVWOSP-UHFFFAOYSA-N |