2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0601 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C23 H29 N O6 S |
| Smiles: | CCSCCOC(c1c(C)c2C(CC(Cc2[nH]1)c1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5732 |
| logD: | 3.5732 |
| logSw: | -3.9179 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.066 |
| InChI Key: | BYQAGEBWHKEPPU-CQSZACIVSA-N |