N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-9,10,10-trioxothioxanthene-3-carboxamide
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N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-9,10,10-trioxothioxanthene-3-carboxamide
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CAS No:
1212135-49-3
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Formula:
C29H21N3O4S
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Chemical Name:
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-9,10,10-trioxothioxanthene-3-carboxamide
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Synonyms:
ZINC5980305;AKOS001060409;MCULE-6476791749;UPCMLD0ENAT5246175:001;Z56988199;1212135-49-3;N-[(1S)-1-(1H-1,3-benzodiazol-2-yl)-2-phenylethyl]-9,10,10-trioxo-9H-10lambda6-thioxanthene-3-carboxamide
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CAS No:
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-9,10,10-trioxothioxanthene-3-carboxamide Basic Attributes
507.6 g/mol
507.12527733 g/mol
Computed Properties
Molecular Weight:507.6
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:507.12527733
Monoisotopic Mass:507.12527733
Topological Polar Surface Area:117
Heavy Atom Count:37
Complexity:959
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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