321998-75-8
Product Name:
1-(4-[1-(4-CHLOROPHENYL)-1H-PYRAZOL-5-YL]PHENYL)-3,3-DIMETHYL-2-AZETANONE
Formula:
C20H18ClN3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 351.8 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 351.1138399 g/mol |
| Monoisotopic Mass | 351.1138399 g/mol |
| Topological Polar Surface Area | 38.1 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 495 |
| 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 |