1024018-70-9
Product Name:
1-(3-NITRO-4-(4-[5-(2-THIENYL)-1H-PYRAZOL-3-YL]PIPERIDINO)PHENYL)-1-ETHANONE
Formula:
C20H20N4O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 396.5 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 396.12561169 g/mol |
| Monoisotopic Mass | 396.12561169 g/mol |
| Topological Polar Surface Area | 123 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 578 |
| 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 |