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Homecas478065-06-4

478065-06-4

478065-06-4 structural image
Product Name: ETHYL 4-(3-[(3,4-DICHLOROBENZOYL)AMINO]PHENOXY)-2-(METHYLSULFANYL)-5-PYRIMIDINECARBOXYLATE
Formula: C21H17Cl2N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 478.3 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 477.0316826 g/mol
Monoisotopic Mass 477.0316826 g/mol
Topological Polar Surface Area 116 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 617
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