478043-90-2
Product Name:
N-(4-CYANO-3-METHYL-5-ISOXAZOLYL)-4-METHYLBENZENECARBOXAMIDE
Formula:
C13H11N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 241.24 g/mol |
---|---|
XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 241.085126602 g/mol |
Monoisotopic Mass | 241.085126602 g/mol |
Topological Polar Surface Area | 78.9 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 355 |
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 |