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850934-84-8

850934-84-8 structural image
Product Name: 3-(tert-butyl)-1-(2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl)-1-(thiophen-2-ylmethyl)thiourea
Formula: C22H29N3OS2
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COMPUTED DESCRIPTORS

Molecular Weight 415.6 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 415.17520490 g/mol
Monoisotopic Mass 415.17520490 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 524
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