2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0215 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 357.47 |
| Molecular Formula: | C20 H23 N O3 S |
| Smiles: | CCSCCOC(c1c(C)c2C(CC(Cc2[nH]1)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0387 |
| logD: | 4.0387 |
| logSw: | -4.1751 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.089 |
| InChI Key: | IBRKYEYOYUDSPF-OAHLLOKOSA-N |