338775-10-3
Product Name:
2-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]SULFANYL)-7-(4-NITROPHENYL)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE
Formula:
C17H8ClF3N6O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 452.8 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 3 |
| Exact Mass | 452.0070069 g/mol |
| Monoisotopic Mass | 452.0070069 g/mol |
| Topological Polar Surface Area | 127 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 621 |
| 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 |