551930-85-9
Product Name:
METHYL 3-((E)-2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]HYDRAZONO)-2-(1H-1,2,4-TRIAZOL-1-YL)PROPANOATE
Formula:
C12H10ClF3N6O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 362.69 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 6 |
| Exact Mass | 362.0505858 g/mol |
| Monoisotopic Mass | 362.0505858 g/mol |
| Topological Polar Surface Area | 94.3 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 467 |
| 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 |