1-[(4-ethenylphenyl)methyl]-4-({[(3-methoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(4-ethenylphenyl)methyl]-4-({[(3-methoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
1-[(4-ethenylphenyl)methyl]-4-({[(3-methoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-2368 |
| Compound Name: | 1-[(4-ethenylphenyl)methyl]-4-({[(3-methoxyphenyl)methyl]amino}methyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C25 H28 N2 O3 |
| Smiles: | Cc1c(CNCc2cccc(c2)OC)c(C(O)=O)c(C)n1Cc1ccc(C=C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3043 |
| logD: | 4.3043 |
| logSw: | -4.4786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.654 |
| InChI Key: | WZYADZVTGWQHTQ-UHFFFAOYSA-N |