115897-54-6
Product Name:
2-(2,4-DICHLOROPHENYL)-2-(1,2,4-TRIAZOL-1-YL METHYL)-1,3-DIOXALANE-4-YL METHYL METHANE SULFONATE
Formula:
C14H15Cl2N3O5S
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COMPUTED DESCRIPTORS
Molecular Weight | 408.3 g/mol |
---|---|
XLogP3 | 1.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 6 |
Exact Mass | 407.0109471 g/mol |
Monoisotopic Mass | 407.0109471 g/mol |
Topological Polar Surface Area | 101 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 563 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |