343375-60-0
Product Name:
5-(DIMETHYLAMINO)-4-PHENYL-2-THIOPHENECARBONITRILE
Formula:
C13H12N2S
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COMPUTED DESCRIPTORS
Molecular Weight | 228.31 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 228.07211956 g/mol |
Monoisotopic Mass | 228.07211956 g/mol |
Topological Polar Surface Area | 55.3 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 275 |
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 |