850349-80-3
Product Name:
6-BROMO-4-(2,2-DIMETHOXYETHYLTHIO)-2-(TRIFLUOROMETHYL)QUINOLINE
Formula:
C14H13BrF3NO2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 396.22 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 394.98025 g/mol |
| Monoisotopic Mass | 394.98025 g/mol |
| Topological Polar Surface Area | 56.6 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 358 |
| 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 |