242472-19-1
Product Name:
1-BENZYL-3-(4-METHYL-5-SULFANYL-4H-1,2,4-TRIAZOL-3-YL)-2(1H)-PYRIDINONE
Formula:
C15H14N4OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 298.4 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 298.08883226 g/mol |
| Monoisotopic Mass | 298.08883226 g/mol |
| Topological Polar Surface Area | 80 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 546 |
| 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 |