1-[(3-chlorophenyl)methyl]-3-{[(2,3-dimethylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-3-{[(2,3-dimethylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
1-[(3-chlorophenyl)methyl]-3-{[(2,3-dimethylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2150 |
| Compound Name: | 1-[(3-chlorophenyl)methyl]-3-{[(2,3-dimethylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 424.97 |
| Molecular Formula: | C25 H29 Cl N2 O2 |
| Smiles: | CC1CCCC(C1C)NCc1c2ccccc2n(Cc2cccc(c2)[Cl])c1C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1661 |
| logD: | 5.1661 |
| logSw: | -5.2669 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.549 |
| InChI Key: | BXYJZBZGBLFTGF-UHFFFAOYSA-N |