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844859-05-8

844859-05-8 structural image
Product Name: 4-(4-ethylpiperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Formula: C18H23N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 341.4 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 341.18517499 g/mol
Monoisotopic Mass 341.18517499 g/mol
Topological Polar Surface Area 66.5 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 445
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes