1-(4-chlorophenyl)-4-[(cyclooctylamino)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1-(4-chlorophenyl)-4-[(cyclooctylamino)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
1-(4-chlorophenyl)-4-[(cyclooctylamino)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G396-1754 |
| Compound Name: | 1-(4-chlorophenyl)-4-[(cyclooctylamino)methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 388.94 |
| Molecular Formula: | C22 H29 Cl N2 O2 |
| Smiles: | Cc1c(CNC2CCCCCCC2)c(C(O)=O)c(C)n1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3297 |
| logD: | 5.3297 |
| logSw: | -5.7193 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.7 |
| InChI Key: | BXRIPHZGGXQIRN-UHFFFAOYSA-N |