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1013566-44-3

1013566-44-3 structural image
Product Name: 1-(4-CHLOROPHENYL)-3-(2-MORPHOLIN-4-YL-5-(TRIFLUOROMETHYL)PHENYL)THIOUREA
Formula: C18H17ClF3N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 415.9 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 415.0732955 g/mol
Monoisotopic Mass 415.0732955 g/mol
Topological Polar Surface Area 68.6 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 497
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