4-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
4-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-1819 |
| Compound Name: | 4-({[(5-bromo-2-methoxyphenyl)methyl]amino}methyl)-1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 477.78 |
| Molecular Formula: | C22 H22 Br Cl N2 O3 |
| Smiles: | Cc1c(CNCc2cc(ccc2OC)[Br])c(C(O)=O)c(C)n1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9066 |
| logD: | 4.9066 |
| logSw: | -4.7868 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.484 |
| InChI Key: | NPWPZKTYCQMAJV-UHFFFAOYSA-N |