1-ethyl-6-methoxy-3-[({2-[4-(methylsulfanyl)phenyl]ethyl}amino)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-ethyl-6-methoxy-3-[({2-[4-(methylsulfanyl)phenyl]ethyl}amino)methyl]-1H-indole-2-carboxylic acid
1-ethyl-6-methoxy-3-[({2-[4-(methylsulfanyl)phenyl]ethyl}amino)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | E518-1146 |
| Compound Name: | 1-ethyl-6-methoxy-3-[({2-[4-(methylsulfanyl)phenyl]ethyl}amino)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 398.52 |
| Molecular Formula: | C22 H26 N2 O3 S |
| Smiles: | CCn1c(C(O)=O)c(CNCCc2ccc(cc2)SC)c2ccc(cc12)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6707 |
| logD: | 3.6707 |
| logSw: | -4.1902 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.024 |
| InChI Key: | VQAJVCXODMENNN-UHFFFAOYSA-N |