344276-97-7
Product Name:
1-[5-(([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)METHYL)-4,5-DIHYDRO-3-ISOXAZOLYL]-3-[4-(TRIFLUOROMETHOXY)ANILINO]-2-PROPEN-1-ONE
Formula:
C20H15ClF6N4O3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 508.8 g/mol |
---|---|
XLogP3 | 5.7 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 13 |
Rotatable Bond Count | 8 |
Exact Mass | 508.0736870 g/mol |
Monoisotopic Mass | 508.0736870 g/mol |
Topological Polar Surface Area | 84.8 Ų |
Heavy Atom Count | 34 |
Formal Charge | 0 |
Complexity | 756 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |