338422-61-0
Product Name:
1-[5-(([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)METHYL)-4,5-DIHYDRO-3-ISOXAZOLYL]-3-(DIMETHYLAMINO)-2-PROPEN-1-ONE
Formula:
C15H16ClF3N4O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 376.76 g/mol |
---|---|
XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 6 |
Exact Mass | 376.0913879 g/mol |
Monoisotopic Mass | 376.0913879 g/mol |
Topological Polar Surface Area | 66.8 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 539 |
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 |