3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methyl-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methyl-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methyl-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0162 |
| Compound Name: | 3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-6-methyl-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 416.56 |
| Molecular Formula: | C27 H32 N2 O2 |
| Smiles: | Cc1ccc2c(CNCCC3CCCCC=3)c(C(O)=O)n(Cc3ccccc3C)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6594 |
| logD: | 5.6594 |
| logSw: | -5.3261 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.676 |
| InChI Key: | JQKZDPNSVNPTJA-UHFFFAOYSA-N |