899384-52-2
Product Name:
3-(2-((4-(2-chlorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoic acid
Formula:
C22H16ClN5O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 465.9 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 465.0662383 g/mol |
| Monoisotopic Mass | 465.0662383 g/mol |
| Topological Polar Surface Area | 135 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 659 |
| 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 |