478081-53-7
Product Name:
4-AMINO-5-BENZOYL-2-[(3,4-DICHLOROBENZYL)SULFANYL]-3-THIOPHENECARBONITRILE
Formula:
C19H12Cl2N2OS2
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COMPUTED DESCRIPTORS
Molecular Weight | 419.3 g/mol |
---|---|
XLogP3 | 6.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 5 |
Exact Mass | 417.9768107 g/mol |
Monoisotopic Mass | 417.9768107 g/mol |
Topological Polar Surface Area | 120 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 549 |
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 |