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866134-83-0

866134-83-0 structural image
Product Name: ETHYL 7-(2-METHOXY-2-OXOETHYL)-4-(2-THIENYLSULFONYL)-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLATE
Formula: C18H19NO7S2
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COMPUTED DESCRIPTORS

Molecular Weight 425.5 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 8
Exact Mass 425.06029429 g/mol
Monoisotopic Mass 425.06029429 g/mol
Topological Polar Surface Area 136 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 678
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes