478045-23-7
Product Name:
3-METHYL-4-([3-(TRIFLUOROMETHYL)PHENYL]SULFANYL)ISOXAZOLO[5,4-D]PYRIMIDINE
Formula:
C13H8F3N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 311.28 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 311.03401755 g/mol |
| Monoisotopic Mass | 311.03401755 g/mol |
| Topological Polar Surface Area | 77.1 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 371 |
| 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 |