321432-02-4
Product Name:
5-[(2-(4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]PIPERAZINO)ETHYL)AMINO]-2,4(1H,3H)-PYRIMIDINEDIONE
Formula:
C16H18ClF3N6O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.80 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 418.1131860 g/mol |
| Monoisotopic Mass | 418.1131860 g/mol |
| Topological Polar Surface Area | 89.6 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 624 |
| 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 |