3-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
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3-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
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CAS No:
840454-96-8
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Formula:
C24H19ClN4S
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Chemical Name:
3-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
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Synonyms:
840454-96-8;3-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile;3-{[(1H-1,3-benzodiazol-2-yl)methyl]sulfanyl}-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile;ZINC2256143;STL361045;AKOS002915061;MCULE-3082006044;3-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile;AB00683044-01;F3129-0217;3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
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CAS No:
3-(1H-benzimidazol-2-ylmethylsulfanyl)-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Basic Attributes
431.0 g/mol
430.1018955 g/mol
Computed Properties
Molecular Weight:431.0
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:430.1018955
Monoisotopic Mass:430.1018955
Topological Polar Surface Area:90.7
Heavy Atom Count:30
Complexity:630
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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