3-(1,3-BENZODIOXOL-5-YL)-3-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)PROPANOIC ACID
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3-(1,3-BENZODIOXOL-5-YL)-3-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)PROPANOIC ACID
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CAS No:
439096-88-5
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Formula:
C14H17NO6S
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Chemical Name:
3-(1,3-BENZODIOXOL-5-YL)-3-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)PROPANOIC ACID
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Synonyms:
GNF-Pf-3067;3-(1,3-benzodioxol-5-yl)-3-(1,1-dioxo-1lambda~6~,4-thiazinan-4-yl)propanoic acid;3-(2H-1,3-benzodioxol-5-yl)-3-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)propanoic acid;Oprea1_470540;CHEMBL600330;AKOS005076187;MCULE-4272732268;KS-00001R81;10R-0612
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CAS No:
3-(1,3-BENZODIOXOL-5-YL)-3-(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)PROPANOIC ACID Basic Attributes
327.35
327.078
Computed Properties
Molecular Weight:327.35
XLogP3:-2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:327.07765844
Monoisotopic Mass:327.07765844
Topological Polar Surface Area:102
Heavy Atom Count:22
Complexity:502
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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