556787-47-4
Product Name:
N-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-2-(4-OXO(3-HYDROQUINAZOLIN-2-YLTHIO))ETHANAMIDE
Formula:
C18H11F6N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 447.4 g/mol |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 4 |
| Exact Mass | 447.04761675 g/mol |
| Monoisotopic Mass | 447.04761675 g/mol |
| Topological Polar Surface Area | 95.9 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 674 |
| 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 |