388572-68-7
Product Name:
4-CHLORO-6,7-DIHYDRO-2-(METHYLTHIO)-7-PHENYL-(5H)-PYRROLO[2,3-D]PYRIMIDINE
Formula:
C13H12ClN3S
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COMPUTED DESCRIPTORS
Molecular Weight | 277.77 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 277.0440463 g/mol |
Monoisotopic Mass | 277.0440463 g/mol |
Topological Polar Surface Area | 54.3 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 285 |
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 |