339025-34-2
Product Name:
N-(3-CHLORO-2-METHYLPHENYL)-4-([2-OXO-5-(TRIFLUOROMETHYL)-1(2H)-PYRIDINYL]METHYL)BENZENECARBOXAMIDE
Formula:
C21H16ClF3N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 420.8 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 420.0852399 g/mol |
| Monoisotopic Mass | 420.0852399 g/mol |
| Topological Polar Surface Area | 49.4 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 684 |
| 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 |