1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-{[(3-methylbutyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-{[(3-methylbutyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-{[(3-methylbutyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-1173 |
| Compound Name: | 1-[(4-methoxyphenyl)methyl]-2,5-dimethyl-4-{[(3-methylbutyl)amino]methyl}-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C21 H30 N2 O3 |
| Smiles: | CC(C)CCNCc1c(C(O)=O)c(C)n(Cc2ccc(cc2)OC)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.3966 |
| logD: | 3.3966 |
| logSw: | -3.6522 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.767 |
| InChI Key: | RFXIKQHKZLCFTM-UHFFFAOYSA-N |