159885-82-2
Product Name:
1-[4-(4-CHLOROPHENYL)-1,3-THIAZOL-2-YL]-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
Formula:
C14H7ClF3N3O2S
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COMPUTED DESCRIPTORS
Molecular Weight | 373.7 g/mol |
---|---|
XLogP3 | 4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 3 |
Exact Mass | 372.9899598 g/mol |
Monoisotopic Mass | 372.9899598 g/mol |
Topological Polar Surface Area | 96.2 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 477 |
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 |