98519-02-9
Product Name:
1H-1,2,4-Triazole, 1-((2-(5,7-dichloro-2-benzofuranyl)-4-(propoxymethy l)-1,3-dioxolan-2-yl)methyl)-, cis-
Formula:
C18H19Cl2N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 412.3 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 411.0752615 g/mol |
| Monoisotopic Mass | 411.0752615 g/mol |
| Topological Polar Surface Area | 71.5 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 505 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |