methyl 2-[[2-[(5-oxo-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetyl]amino]benzoate
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methyl 2-[[2-[(5-oxo-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetyl]amino]benzoate
structure -
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CAS No:
721421-49-4
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Formula:
C22H19N5O4S
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Chemical Name:
methyl 2-[[2-[(5-oxo-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetyl]amino]benzoate
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Synonyms:
AKOS002452842;MCULE-3871616614;AB00714914-01;SR-01000036868;SR-01000036868-1;Z16439666;721421-49-4;methyl 2-(2-{[5-oxo-4-(prop-2-en-1-yl)-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamido)benzoate
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CAS No:
methyl 2-[[2-[(5-oxo-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]acetyl]amino]benzoate Basic Attributes
449.5 g/mol
449.11577528 g/mol
Computed Properties
Molecular Weight:449.5
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:449.11577528
Monoisotopic Mass:449.11577528
Topological Polar Surface Area:132
Heavy Atom Count:32
Complexity:737
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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