287922-40-1
Product Name:
4-AMINO-2-(4-METHYLPHENYL)-6-(METHYLTHIO)PYRIMIDINE-5-CARBONITRILE
Formula:
C13H12N4S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | <0.1 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 256.33 g/mol |
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XLogP3 | 3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 256.07826757 g/mol |
Monoisotopic Mass | 256.07826757 g/mol |
Topological Polar Surface Area | 101 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 318 |
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 |