4-{[(3-ethoxypropyl)amino]methyl}-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
4-{[(3-ethoxypropyl)amino]methyl}-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
4-{[(3-ethoxypropyl)amino]methyl}-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-0525 |
| Compound Name: | 4-{[(3-ethoxypropyl)amino]methyl}-2,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C21 H30 N2 O3 |
| Smiles: | CCOCCCNCc1c(C(O)=O)c(C)n(Cc2ccccc2C)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.2025 |
| logD: | 3.2025 |
| logSw: | -3.1965 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.2 |
| InChI Key: | YSZLKILRAFXGKK-UHFFFAOYSA-N |