853783-14-9
Product Name:
5-ACETYL-4-HYDROXY-6-PHENYL-4-(TRIFLUOROMETHYL)TETRAHYDROPYRIMIDIN-2(1H)-ONE
Formula:
C13H13F3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 302.25 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 302.08782677 g/mol |
| Monoisotopic Mass | 302.08782677 g/mol |
| Topological Polar Surface Area | 78.4 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 435 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |