5-bromo-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyridine-3-carboxamide
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5-bromo-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyridine-3-carboxamide
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CAS No:
728903-76-2
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Formula:
C19H18BrN5O
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Chemical Name:
5-bromo-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyridine-3-carboxamide
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Synonyms:
ZINC3275214;AKOS033992812;MCULE-1318324074;SR-01000039969;SR-01000039969-1;Z27146128;5-bromo-N-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)pyridine-3-carboxamide;728903-76-2
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CAS No:
5-bromo-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyridine-3-carboxamide Basic Attributes
412.3 g/mol
411.06947 g/mol
Computed Properties
Molecular Weight:412.3
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:411.06947
Monoisotopic Mass:411.06947
Topological Polar Surface Area:72.7
Heavy Atom Count:26
Complexity:485
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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