5-(2-Ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione
5-(2-ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione
Also Known As: Oprea1_243055|Oprea1_872663|BAS 00746396|5-(2-ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione|AB00075709-01|5-(2-ethylthiopropyl)-2-(pyrrolidinylbutylidene)cyclohexane-1,3-dione|5-[2-(ethylthio)propyl]-2-(1-pyrrolidinobutylidene)cyclohexane-1,3-quinone|5-[2-(Ethylsulfanyl)propyl]-2-[1-(1-pyrrolidinyl)butylidene]-1,3-cyclohexanedione #|5-[2-(ethylsulfanyl)propyl]-2-[1-(pyrrolidin-1-yl)butylidene]cyclohexane-1,3-dione|5-[2-(ethylthio)propyl]-2-[1-(1-pyrrolidinyl)butylidene]-1,3-cyclohexanedione|5-[2-(ethylthio)propyl]-2-[1-(1-pyrrolidinyl)butylidene]cyclohexane-1,3-dione|Cyclohexane-1,3-dione, 5-(2-ethylthio)propyl-2-[1-(1-pyrrolidinyl)butylidene]-
| Molecular Formula | C19H31NO2S |
|---|---|
| Molecular Weight | 337.20755 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 337.20755 |
| Monoisotopic Mass | 337.20755 |
| Heavy Atoms | 23 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 331985-96-7 |
|---|---|
| SMILES | CCCC(=C1C(=O)CC(CC1=O)CC(C)SCC)N2CCCC2 |
| InChIKey | FYRNLYAWMQKHCA-UHFFFAOYSA-N |
Product Overview
5-(2-Ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione (CAS 331985-96-7), with molecular formula C19H31NO2S and molecular weight 337.20755 g/mol. IUPAC: 5-(2-ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione.
5-(2-Ethylsulfanylpropyl)-2-(1-pyrrolidin-1-ylbutylidene)cyclohexane-1,3-dione is a custom synthesis product. We offer services from milligram to kilogram scale.
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