338407-19-5
Product Name:
4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-(PHENYLSULFONYL)BUTANOIC ACID
Formula:
C16H13ClF3NO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 407.8 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 407.0205912 g/mol |
| Monoisotopic Mass | 407.0205912 g/mol |
| Topological Polar Surface Area | 92.7 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 587 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |