(4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(azepan-1-ylsulfonyl)benzoate
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(4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(azepan-1-ylsulfonyl)benzoate
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CAS No:
455297-79-7
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Formula:
C21H22N4O5S
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Chemical Name:
(4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(azepan-1-ylsulfonyl)benzoate
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Synonyms:
Oprea1_875870;ZINC2661732;AKOS033632598;MCULE-3834265866;Z18577973;(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)methyl 3-(azepane-1-sulfonyl)benzoate;455297-79-7
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CAS No:
(4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(azepan-1-ylsulfonyl)benzoate Basic Attributes
442.5 g/mol
442.13109099 g/mol
Computed Properties
Molecular Weight:442.5
XLogP3:3.6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:442.13109099
Monoisotopic Mass:442.13109099
Topological Polar Surface Area:117
Heavy Atom Count:31
Complexity:788
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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