400075-00-5
Product Name:
1-[(4-chlorophenyl)methyl]-3-[4-ethyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,2-dihydropyridin-2-one
Formula:
C17H17ClN4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 360.9 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 360.0811600 g/mol |
| Monoisotopic Mass | 360.0811600 g/mol |
| Topological Polar Surface Area | 76.3 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 519 |
| 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 |