338399-46-5
Product Name:
1-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-2,4-dioxo-3-(2-[3-(trifluoromethyl)phenoxy]ethyl)-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile
Formula:
C21H14ClF6N5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 533.8 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 6 |
| Exact Mass | 533.0689360 g/mol |
| Monoisotopic Mass | 533.0689360 g/mol |
| Topological Polar Surface Area | 89.8 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 920 |
| 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 |