343373-38-6
Product Name:
4-(4-Bromophenyl)-2-(3-methoxybenzyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Formula:
C16H14BrN3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 360.20 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 359.02694 g/mol |
| Monoisotopic Mass | 359.02694 g/mol |
| Topological Polar Surface Area | 45.1 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 424 |
| 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 |