54346-18-8
Product Name:
2-(METHYLTHIO)PYRAZOLO[1,5-A][1,3,5]TRIAZIN-4(3H)-ONE
Formula:
C6H6N4OS
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 182.21 g/mol |
---|---|
XLogP3 | 0.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 1 |
Exact Mass | 182.02623200 g/mol |
Monoisotopic Mass | 182.02623200 g/mol |
Topological Polar Surface Area | 84.6 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 242 |
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 |
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