331837-63-9
Product Name:
3-[(3-chloro-4-methoxyphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine
Formula:
C11H13ClN4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 284.77 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 284.0498599 g/mol |
| Monoisotopic Mass | 284.0498599 g/mol |
| Topological Polar Surface Area | 91.3 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 273 |
| 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 |