338403-28-4
Product Name:
4-[(3,5-DICHLOROANILINO)METHYLENE]-2-[4-(TRIFLUOROMETHOXY)PHENYL]-5-(TRIFLUOROMETHYL)-2,4-DIHYDRO-3H-PYRAZOL-3-ONE
Formula:
C18H9Cl2F6N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 484.2 g/mol |
---|---|
XLogP3 | 6.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 10 |
Rotatable Bond Count | 4 |
Exact Mass | 482.9976009 g/mol |
Monoisotopic Mass | 482.9976009 g/mol |
Topological Polar Surface Area | 53.9 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 725 |
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 |