338749-64-7
Product Name:
(2-METHYL-5-[4-(METHYLSULFONYL)PHENYL]-1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROL-3-YL)METHYL 3-CHLORO-2,2-DIMETHYLPROPANOATE
Formula:
C25H25ClF3NO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 528.0 g/mol |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 527.1144916 g/mol |
| Monoisotopic Mass | 527.1144916 g/mol |
| Topological Polar Surface Area | 73.8 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 837 |
| 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 |