303995-93-9
Product Name:
2,2,2-TRICHLORO-1-(4-[(5-METHYL-3-PHENYL-4-ISOXAZOLYL)CARBONYL]-1H-PYRROL-2-YL)-1-ETHANONE
Formula:
C17H11Cl3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 397.6 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 395.983525 g/mol |
| Monoisotopic Mass | 395.983525 g/mol |
| Topological Polar Surface Area | 76 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 520 |
| 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 |