303996-62-5
Product Name:
1-(4-CHLOROPHENYL)-3-(DIMETHYLAMINO)-2-(1H-1,2,4-TRIAZOL-1-YL)-2-PROPEN-1-ONE
Formula:
C13H13ClN4O
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COMPUTED DESCRIPTORS
| Molecular Weight | 276.72 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 276.0777887 g/mol |
| Monoisotopic Mass | 276.0777887 g/mol |
| Topological Polar Surface Area | 51 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 351 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |