1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-4-{[(1-phenylethyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-4-{[(1-phenylethyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-4-{[(1-phenylethyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | C879-1387 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-2,5-dimethyl-4-{[(1-phenylethyl)amino]methyl}-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 390.53 |
| Molecular Formula: | C25 H30 N2 O2 |
| Smiles: | CC(c1ccccc1)NCc1c(C(O)=O)c(C)n(Cc2cc(C)ccc2C)c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1591 |
| logD: | 5.1591 |
| logSw: | -4.8624 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.064 |
| InChI Key: | YHWDIXDGQSHZBE-SFHVURJKSA-N |