306980-38-1
Product Name:
N-(4-[(4-CHLOROPHENYL)SULFANYL]-3-CYANOPHENYL)-3-(TRIFLUOROMETHYL)BENZENECARBOXAMIDE
Formula:
C21H12ClF3N2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 432.8 g/mol |
|---|---|
| XLogP3 | 6.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 432.0310964 g/mol |
| Monoisotopic Mass | 432.0310964 g/mol |
| Topological Polar Surface Area | 78.2 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 615 |
| 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 |