338777-44-9
Product Name:
2-[(3-CYANO-2-THIENYL)AMINO]-2-OXOETHYL 2-[3-(TRIFLUOROMETHYL)PHENYL]ACETATE
Formula:
C16H11F3N2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 368.3 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 368.04424788 g/mol |
| Monoisotopic Mass | 368.04424788 g/mol |
| Topological Polar Surface Area | 107 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 547 |
| 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 |