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148367-85-5

148367-85-5 structural image
Product Name: ETHYL 5-CYANAMIDE-4-(3,5-DICHLOROPHENYL)-4,5-DIHYDRO-1,3,4-THIADIAZOLE-2-CARBOXYLATE
Formula: C12H8Cl2N4O2S
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COMPUTED DESCRIPTORS

Molecular Weight 343.2 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 341.9745021 g/mol
Monoisotopic Mass 341.9745021 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 521
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