383145-60-6
Product Name:
4-PHENYL-5-([3-(TRIFLUOROMETHYL)PHENOXY]METHYL)-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
Formula:
C16H12F3N3OS
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COMPUTED DESCRIPTORS
Molecular Weight | 351.3 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 351.06531767 g/mol |
Monoisotopic Mass | 351.06531767 g/mol |
Topological Polar Surface Area | 69 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 491 |
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 |