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1987007-45-3

1987007-45-3 structural image
Product Name: 1-(4-CHLOROBENZOYL)-3-(4-FORMYLPIPERAZINYL)THIOUREA
Formula: C13H15ClN4O2S
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COMPUTED DESCRIPTORS

Molecular Weight 326.80 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 326.0604246 g/mol
Monoisotopic Mass 326.0604246 g/mol
Topological Polar Surface Area 96.8 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 394
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