4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0111 |
| Compound Name: | 4-({[(furan-2-yl)methyl]amino}methyl)-2,5-dimethyl-1-[(3-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C21 H24 N2 O3 |
| Smiles: | Cc1cccc(Cn2c(C)c(CNCc3ccco3)c(C(O)=O)c2C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8006 |
| logD: | 3.8006 |
| logSw: | -4.1579 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.859 |
| InChI Key: | HHSVDTZEWISFKP-UHFFFAOYSA-N |