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733030-56-3

733030-56-3 structural image
Product Name: 2-(1-CHLOROETHYL)-7-METHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE
Formula: C13H15ClN2OS
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COMPUTED DESCRIPTORS

Molecular Weight 282.79 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 282.0593620 g/mol
Monoisotopic Mass 282.0593620 g/mol
Topological Polar Surface Area 69.7 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 401
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes