309745-18-4
Product Name:
2-{[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide
Formula:
C21H12F3N5OS3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 503.5 g/mol |
---|---|
XLogP3 | 5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 11 |
Rotatable Bond Count | 6 |
Exact Mass | 503.01560803 g/mol |
Monoisotopic Mass | 503.01560803 g/mol |
Topological Polar Surface Area | 173 Ų |
Heavy Atom Count | 33 |
Formal Charge | 0 |
Complexity | 730 |
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 |