861206-19-1
Product Name:
1H-1,2,4-Triazole-1-acetonitrile, 4-(2,6-difluorophenyl)-4,5-dihydro-3-methyl-5-oxo-
Formula:
C11H8F2N4O
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 250.20 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 250.06661722 g/mol |
| Monoisotopic Mass | 250.06661722 g/mol |
| Topological Polar Surface Area | 59.7 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 420 |
| 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 |