1-phenyl-4-[5-(4-phenylpiperazin-1-ium-1-ylidene)penta-1,3-dienyl]piperazine;dichloride;trihydrate
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1-phenyl-4-[5-(4-phenylpiperazin-1-ium-1-ylidene)penta-1,3-dienyl]piperazine;dichloride;trihydrate
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CAS No:
63867-59-4
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Formula:
C50H68Cl2N8O3
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Chemical Name:
1-phenyl-4-[5-(4-phenylpiperazin-1-ium-1-ylidene)penta-1,3-dienyl]piperazine;dichloride;trihydrate
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Synonyms:
63867-59-4;4-Phenyl-1-(5-(4-phenylpiperazino)-2,4-pentadienylidene)piperazinium chloride sesquihydrate;DTXSID70980527;Piperazinium, 4-phenyl-1-(5-(4-phenylpiperazino)-2,4-pentadienylidene)-, chloride, sesquihydrate;4-Phenyl-1-[5-(4-phenylpiperazin-1-yl)penta-2,4-dien-1-ylidene]piperazin-1-ium chloride--water (2/2/3)
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CAS No:
1-phenyl-4-[5-(4-phenylpiperazin-1-ium-1-ylidene)penta-1,3-dienyl]piperazine;dichloride;trihydrate Basic Attributes
900.0 g/mol
898.4791434 g/mol
Computed Properties
Molecular Weight:900.0
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:898.4791434
Monoisotopic Mass:898.4791434
Topological Polar Surface Area:28.5
Heavy Atom Count:63
Complexity:503
Undefined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:7
Compound Is Canonicalized:Yes
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