338751-45-4
Product Name:
2-[(2-CHLORO-6-FLUOROBENZYL)SULFANYL]-7-(4-METHOXYPHENYL)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE
Formula:
C19H14ClFN4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 400.9 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 400.0560881 g/mol |
| Monoisotopic Mass | 400.0560881 g/mol |
| Topological Polar Surface Area | 77.6 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 485 |
| 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 |