4-methylbenzenesulfonic acid;10-[3-[4-(2-pyridin-1-ium-1-ylethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine
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![4-methylbenzenesulfonic acid;10-[3-[4-(2-pyridin-1-ium-1-ylethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c79e8539c5ae4d69b084f1f1062061e7.png "4-methylbenzenesulfonic acid;10-[3-[4-(2-pyridin-1-ium-1-ylethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine")
4-methylbenzenesulfonic acid;10-[3-[4-(2-pyridin-1-ium-1-ylethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine
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CAS No:
66422-02-4
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Formula:
C34H38F3N4O3S2+
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Chemical Name:
4-methylbenzenesulfonic acid;10-[3-[4-(2-pyridin-1-ium-1-ylethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine
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Synonyms:
NSC173341;66422-02-4;DTXSID90329959;NSC-173341
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CAS No:
4-methylbenzenesulfonic acid;10-[3-[4-(2-pyridin-1-ium-1-ylethyl)piperazin-1-yl]propyl]-2-(trifluoromethyl)phenothiazine Basic Attributes
671.8 g/mol
671.23374292 g/mol
173341
DTXSID90329959
Computed Properties
Molecular Weight:671.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:671.23374292
Monoisotopic Mass:671.23374292
Topological Polar Surface Area:102
Heavy Atom Count:46
Formal Charge:1
Complexity:857
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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