1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E847-0403 |
| Compound Name: | 1-[(4-ethenylphenyl)methyl]-6-methyl-3-({[2-(thiophen-2-yl)ethyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C26 H26 N2 O2 S |
| Smiles: | Cc1ccc2c(CNCCc3cccs3)c(C(O)=O)n(Cc3ccc(C=C)cc3)c2c1 |
| Stereo: | ACHIRAL |
| logP: | 5.086 |
| logD: | 5.086 |
| logSw: | -4.7176 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.502 |
| InChI Key: | BWUJTPPFLCBPDV-UHFFFAOYSA-N |