(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline;perchloric acid
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![(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline;perchloric acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e4c4aa285cae4e86bff603278c4ea485.png "(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline;perchloric acid")
(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline;perchloric acid
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CAS No:
96795-89-0
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Formula:
C19H22ClNO4S
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Chemical Name:
(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline;perchloric acid
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Synonyms:
McN 5652;McN 5652-X-68;McN-5652;McN-5652-Z;McN-5652-Z-68;MCN-5652Z68;Mcn-5652-Z-68;UNII-5KXU86QWCS;Mcn-5652;5KXU86QWCS;Mcn 5652;Mcn-5652-Z;Mcn 5652-X-68;McN-5652Z;MCN-5652X68;109214-59-7;96795-90-3;Pyrrolo(2,1-a)isoquinoline, 1,2,3,5,6,10b-hexahydro-6-(4-(methylthio)phenyl)-, (6S,10bR)-, perchlorate (1:1);Pyrrolo(2,1-a)isoquinoline, 1,2,3,5,6,10b-hexahydro-6-(4-(methylthio)phenyl)-, trans-, perchlorate;UNII-96GSK40TLP component PBALTVQMQFVDBV-GRTNUQQKSA-N
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CAS No:
(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline;perchloric acid Basic Attributes
395.9 g/mol
395.0958071 g/mol
5KXU86QWCS
Drug Information
Chemicals administered to patients in order to diagnose or study the pathology of medical conditions, diseases, or syndromes. (See all compounds classified as Diagnostic Uses of Chemicals.)|Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS. (See all compounds classified as Serotonin Antagonists.)
McN 5652
Computed Properties
Molecular Weight:395.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:395.0958071
Monoisotopic Mass:395.0958071
Topological Polar Surface Area:100
Heavy Atom Count:26
Complexity:463
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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