2,6-diamino-4-(4-bromo-2-fluorophenyl)-4H-thiopyran-3,5-dicarbonitrile
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2,6-diamino-4-(4-bromo-2-fluorophenyl)-4H-thiopyran-3,5-dicarbonitrile
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CAS No:
316357-91-2
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Formula:
C13H8BrFN4S
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Chemical Name:
2,6-diamino-4-(4-bromo-2-fluorophenyl)-4H-thiopyran-3,5-dicarbonitrile
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Synonyms:
ZINC2361776;STL323847;2,6-diamino-4-(4-bromo-2-fluorophenyl)-4H-thiopyran-3,5-dicarbonitrile;AKOS003678161;MCULE-5191361513;316357-91-2
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CAS No:
2,6-diamino-4-(4-bromo-2-fluorophenyl)-4H-thiopyran-3,5-dicarbonitrile Basic Attributes
351.20 g/mol
349.96371 g/mol
Computed Properties
Molecular Weight:351.20
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:349.96371
Monoisotopic Mass:349.96371
Topological Polar Surface Area:125
Heavy Atom Count:20
Complexity:544
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2,6-diamino-4-(4-bromo-2-fluorophenyl)-4H-thiopyran-3,5-dicarbonitrile
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