1-[(3-fluorophenyl)methyl]-2,5-dimethyl-4-{[(3-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-[(3-fluorophenyl)methyl]-2,5-dimethyl-4-{[(3-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
1-[(3-fluorophenyl)methyl]-2,5-dimethyl-4-{[(3-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-0402 |
| Compound Name: | 1-[(3-fluorophenyl)methyl]-2,5-dimethyl-4-{[(3-phenylpropyl)amino]methyl}-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C24 H27 F N2 O2 |
| Smiles: | Cc1c(CNCCCc2ccccc2)c(C(O)=O)c(C)n1Cc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 4.4824 |
| logD: | 4.4824 |
| logSw: | -4.4949 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.951 |
| InChI Key: | KOCTZJCTWVIONC-UHFFFAOYSA-N |