2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0141 |
| Compound Name: | 2,5-dimethyl-1-[(3-methylphenyl)methyl]-4-({[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C26 H32 N2 O5 |
| Smiles: | Cc1cccc(Cn2c(C)c(CNCc3cc(c(c(c3)OC)OC)OC)c(C(O)=O)c2C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0408 |
| logD: | 4.0408 |
| logSw: | -4.2824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.088 |
| InChI Key: | MUPKBJHRINVTDP-UHFFFAOYSA-N |