RU 41656
(2R,7R)-6-methyl-4-(methylsulfanylmethyl)-3-oxa-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraene
Also Known As: RU 41656|RU 41-656|VOXERGOLIDE HYDROCHLORIDE|Voxergolide hydrochloride < Rec INNM >|6-methyl-8-[(methylthio)methyl]-9-oxaergoline|(2R,7R)-6-Methyl-4-(methylsulfanylmethyl)-3-oxa-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraene|Rac-6-Methyl-8beta-(methylthiomethyl)-9-oxaergoline hydrochloride|(2R,7R)-6-methyl-4-[(methylsulfanyl)methyl]-3-oxa-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraene|Rac-(6aR,9R,10aR)-9-[(Methylthio)methyl]-7-methyl-4,6a,7,8,9,10a-hexahydro-6H-indolo[3,4-gh][1,4]benzoxazine hydrochloride
| Molecular Formula | C16H20N2OS |
|---|---|
| Molecular Weight | 288.12964 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.12964 |
| Monoisotopic Mass | 288.12964 |
| Heavy Atoms | 20 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 89651-01-4 |
|---|---|
| SMILES | CN1CC(O[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CSC |
| InChIKey | GYUHVILBXXBZDS-PXFYRTPJSA-N |
Product Overview
RU 41656 (CAS 89651-01-4), with molecular formula C16H20N2OS and molecular weight 288.12964 g/mol. IUPAC: (2R,7R)-6-methyl-4-(methylsulfanylmethyl)-3-oxa-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),9,12,14-tetraene.
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