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477710-45-5

477710-45-5 structural image
Product Name: ETHYL 3,5-DIMETHYL-1-(5-[(2-THIENYLCARBONYL)AMINO]-2-PYRIDINYL)-1H-PYRAZOLE-4-CARBOXYLATE
Formula: C18H18N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 370.4 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 370.10996162 g/mol
Monoisotopic Mass 370.10996162 g/mol
Topological Polar Surface Area 114 Ų
Heavy Atom Count 26
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