171764-49-1
Product Name:
(2R,4R) CIS-(2,4-DIFLUOROPHENYL)-2-(1,2,4-TRIAZOLE-1-YL-METHYL)-1,3-DIOXOLANE-4YL-METHYL-P-TOLYSULFONATE
Formula:
C14H15F2N3O5S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 449.5 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 449.12208366 g/mol |
| Monoisotopic Mass | 449.12208366 g/mol |
| Topological Polar Surface Area | 91.7 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 687 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |