1-[(4-chlorophenyl)methyl]-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-chlorophenyl)methyl]-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-2254 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 422.95 |
| Molecular Formula: | C25 H27 Cl N2 O2 |
| Smiles: | C1CCC(CCNCc2c3ccccc3n(Cc3ccc(cc3)[Cl])c2C(O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.9883 |
| logD: | 4.9883 |
| logSw: | -4.8255 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.676 |
| InChI Key: | JEFGZONRXRIBBW-UHFFFAOYSA-N |