2-oxo-6-phenyl-4,6-dihydro-3H-5,1-benzothiazocine-1-carboxylic acid
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2-oxo-6-phenyl-4,6-dihydro-3H-5,1-benzothiazocine-1-carboxylic acid
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CAS No:
85099-00-9
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Formula:
C17H15NO3S
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Chemical Name:
2-oxo-6-phenyl-4,6-dihydro-3H-5,1-benzothiazocine-1-carboxylic acid
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Synonyms:
6-phenyl-1,3,4,6-tetrahydro-2H-5,1-benzothiazocin-2-one-1-carboxylic acid;6-PTBOC;85099-00-9;6-Ptboc;2H-5,1-Benzothiazocine-1(6H)-carboxylic acid, 3,4-dihydro-2-oxo-6-phenyl-;6-Phenyl-1,3,4,6-tetrahydro-2H-5,1-benzothiazocin-2-one-1-carboxylic acid;DTXSID401005473;2-oxo-6-phenyl-3,4-dihydro-2H-5,1-benzothiazocine-1(6H)-carboxylic acid
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CAS No:
2-oxo-6-phenyl-4,6-dihydro-3H-5,1-benzothiazocine-1-carboxylic acid Basic Attributes
313.4 g/mol
313.07726451 g/mol
Computed Properties
Molecular Weight:313.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:313.07726451
Monoisotopic Mass:313.07726451
Topological Polar Surface Area:82.9
Heavy Atom Count:22
Complexity:422
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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