339012-79-2
Product Name:
1-(3-CHLORO-2-THIENYL)-3-[3-(TRIFLUOROMETHYL)ANILINO]-2-PROPEN-1-ONE
Formula:
C14H9ClF3NOS
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COMPUTED DESCRIPTORS
| Molecular Weight | 331.7 g/mol |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 331.0045473 g/mol |
| Monoisotopic Mass | 331.0045473 g/mol |
| Topological Polar Surface Area | 57.3 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 402 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |