338399-26-1
Product Name:
1-[[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL](METHYL)AMINO]-3-(4-FLUOROBENZYL)-2,4-DIOXO-1,2,3,4-TETRAHYDRO-5-PYRIMIDINECARBONITRILE
Formula:
C19H12ClF4N5O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 453.8 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 4 |
Exact Mass | 453.0615650 g/mol |
Monoisotopic Mass | 453.0615650 g/mol |
Topological Polar Surface Area | 80.5 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 790 |
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 |