303996-66-9
Product Name:
4-(4-CHLOROPHENYL)-5-(1H-1,2,4-TRIAZOL-1-YL)-2-PYRIMIDINAMINE
Formula:
C12H9ClN6
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COMPUTED DESCRIPTORS
| Molecular Weight | 272.69 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 272.0577220 g/mol |
| Monoisotopic Mass | 272.0577220 g/mol |
| Topological Polar Surface Area | 82.5 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 296 |
| 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 |