338403-80-8
Product Name:
2-[(2,6-DICHLOROBENZYL)SULFANYL]-6-(4-FLUOROPHENYL)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-AMINE
Formula:
C18H12Cl2FN5S
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COMPUTED DESCRIPTORS
Molecular Weight | 420.3 g/mol |
---|---|
XLogP3 | 5.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 419.0174501 g/mol |
Monoisotopic Mass | 419.0174501 g/mol |
Topological Polar Surface Area | 94.4 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 488 |
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 |