339017-66-2
Product Name:
4-[(4-CHLOROPHENYL)SULFANYL]-6-[4-(2-ETHOXYPHENYL)PIPERAZINO]-2-PYRIMIDINAMINE
Formula:
C22H24ClN5OS
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COMPUTED DESCRIPTORS
Molecular Weight | 442.0 g/mol |
---|---|
XLogP3 | 5.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 6 |
Exact Mass | 441.1390093 g/mol |
Monoisotopic Mass | 441.1390093 g/mol |
Topological Polar Surface Area | 92.8 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 516 |
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 |