478065-17-7
Product Name:
(Z)-3-(2-[(4-CHLOROBENZYL)SULFANYL]-3-QUINOLINYL)-2-PHENYL-2-PROPENENITRILE
Formula:
C25H17ClN2S
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COMPUTED DESCRIPTORS
Molecular Weight | 412.9 g/mol |
---|---|
XLogP3 | 6.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 5 |
Exact Mass | 412.0800974 g/mol |
Monoisotopic Mass | 412.0800974 g/mol |
Topological Polar Surface Area | 62 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 597 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |