321553-38-2
Product Name:
1H-Pyrazole-4-carboxamide, N-(4-methoxyphenyl)-1-methyl-5-[(phenylmethyl)thio]-3-(trifluoromethyl)-
Formula:
C20H18F3N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 421.4 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 421.10718249 g/mol |
| Monoisotopic Mass | 421.10718249 g/mol |
| Topological Polar Surface Area | 81.4 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 538 |
| 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 |