3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid
3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-0595 |
| Compound Name: | 3-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methyl)-1-[(4-ethenylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 414.55 |
| Molecular Formula: | C27 H30 N2 O2 |
| Smiles: | C=Cc1ccc(Cn2c(C(O)=O)c(CNCCC3CCCCC=3)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9879 |
| logD: | 4.9879 |
| logSw: | -4.5718 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.676 |
| InChI Key: | OHMZBRYUOXLLAO-UHFFFAOYSA-N |