338403-20-6
Product Name:
5-[2-(4-CHLOROANILINO)VINYL]-3-(2-CHLORO-6-FLUOROPHENYL)-4-ISOXAZOLECARBONITRILE
Formula:
C18H10Cl2FN3O
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COMPUTED DESCRIPTORS
Molecular Weight | 374.2 g/mol |
---|---|
XLogP3 | 5.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 373.0184955 g/mol |
Monoisotopic Mass | 373.0184955 g/mol |
Topological Polar Surface Area | 61.8 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 518 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |