Bentipimine
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Bentipimine
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CAS No:
17692-23-8
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Formula:
C27H31ClN2S
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Chemical Name:
Bentipimine
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Synonyms:
Bentipimine;Bentipimina;Bentipiminum;1-(2-(((2-Chlorophenyl)(phenyl)methyl)thio)ethyl)-4-(2-methylbenzyl)piperazine;Bentipimine [INN];SCHEMBL2112425;CHEMBL2104162;1-[2-[(2-chlorophenyl)-phenylmethyl]sulfanylethyl]-4-[(2-methylphenyl)methyl]piperazine;Q27266470;1-(2-((o-Chloro-alpha-phenylbenzyl)thio)ethyl)-4-(o-methylbenzyl)piperazine
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CAS No:
Computed Properties
Molecular Weight:451.1
XLogP3:6.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:450.1896479
Monoisotopic Mass:450.1896479
Topological Polar Surface Area:31.8
Heavy Atom Count:31
Complexity:504
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes