328282-10-6
Product Name:
5-ACETYL-2-[(3,4-DICHLOROBENZYL)SULFANYL]-6-METHYLNICOTINONITRILE
Formula:
C16H12Cl2N2OS
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COMPUTED DESCRIPTORS
Molecular Weight | 351.2 g/mol |
---|---|
XLogP3 | 4.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 350.0047396 g/mol |
Monoisotopic Mass | 350.0047396 g/mol |
Topological Polar Surface Area | 79 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 453 |
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 |