2-(methylsulfanyl)ethyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
2-(methylsulfanyl)ethyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
2-(methylsulfanyl)ethyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
Compound ID: | C276-0311 |
Compound Name: | 2-(methylsulfanyl)ethyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
Molecular Weight: | 349.47 |
Molecular Formula: | C17 H19 N O3 S2 |
Smiles: | Cc1c2C(CC(Cc2[nH]c1C(=O)OCCSC)c1cccs1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1179 |
logD: | 3.1179 |
logSw: | -3.1517 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.107 |
InChI Key: | XMNPQVUAHOJUNI-NSHDSACASA-N |