881041-60-7
Product Name:
5-(4-BROMO-PHENYL)-1-(3-CHLORO-2-METHYL-PHENYL)-2-METHYL-1H-PYRROLE-3-CARBOXYLIC ACID
Formula:
C19H15BrClNO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 404.7 g/mol |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 402.99747 g/mol |
| Monoisotopic Mass | 402.99747 g/mol |
| Topological Polar Surface Area | 42.2 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 455 |
| 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 |