852407-20-6
Product Name:
Acetamide, 2-[[4-amino-5-(2-bromophenyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-phenoxyphenyl)-
Formula:
C22H18BrN5O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 496.4 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 495.03646 g/mol |
| Monoisotopic Mass | 495.03646 g/mol |
| Topological Polar Surface Area | 120 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 582 |
| 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 |