3-methyl-6-[[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]sulfonyl]-1,3-benzoxazol-2-one
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3-methyl-6-[[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]sulfonyl]-1,3-benzoxazol-2-one
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CAS No:
1212483-25-4
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Formula:
C19H19N3O5S
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Chemical Name:
3-methyl-6-[[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]sulfonyl]-1,3-benzoxazol-2-one
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Synonyms:
ZINC2131121;STL529879;AKOS032429698;(5S)-3-[(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one;1212483-25-4
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CAS No:
3-methyl-6-[[(1R,9S)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]sulfonyl]-1,3-benzoxazol-2-one Basic Attributes
401.4 g/mol
401.10454189 g/mol
Computed Properties
Molecular Weight:401.4
XLogP3:0.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:401.10454189
Monoisotopic Mass:401.10454189
Topological Polar Surface Area:95.6
Heavy Atom Count:28
Complexity:877
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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