1-[(4-ethenylphenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-ethenylphenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
1-[(4-ethenylphenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-0717 |
| Compound Name: | 1-[(4-ethenylphenyl)methyl]-6-methoxy-3-{[(4-methylcyclohexyl)amino]methyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C27 H32 N2 O3 |
| Smiles: | CC1CCC(CC1)NCc1c2ccc(cc2n(Cc2ccc(C=C)cc2)c1C(O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.9802 |
| logD: | 5.9802 |
| logSw: | -5.6283 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.702 |
| InChI Key: | KJYRZLYGFMXTAF-UHFFFAOYSA-N |