242460-44-2
Product Name:
4-CHLORO-2-[7-(1,1,2,2-TETRAFLUOROETHYL)-2,3-DIHYDRO-1H-1,4-DIAZEPIN-5-YL]PHENOL
Formula:
C13H11ClF4N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 322.68 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 322.0496033 g/mol |
| Monoisotopic Mass | 322.0496033 g/mol |
| Topological Polar Surface Area | 44.6 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 442 |
| 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 |