680214-53-3
Product Name:
DIPHENYL [(3-CHLOROPHENYL)(([2-CHLORO-5-(TRIFLUOROMETHYL)ANILINO]CARBOTHIOYL)AMINO)METHYL]PHOSPHONATE
Formula:
C27H20Cl2F3N2O3PS
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COMPUTED DESCRIPTORS
| Molecular Weight | 611.4 g/mol |
|---|---|
| XLogP3 | 8.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 610.0261405 g/mol |
| Monoisotopic Mass | 610.0261405 g/mol |
| Topological Polar Surface Area | 91.7 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 822 |
| 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 |