318239-46-2
Product Name:
4-[1-METHYL-5-(2,2,2-TRICHLOROACETYL)-1H-PYRROL-3-YL]-2-([3-(TRIFLUOROMETHYL)PHENOXY]METHYL)-1,3-THIAZOL-3-IUM BROMIDE
Formula:
C18H13BrCl3F3N2O2S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 564.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 561.88988 g/mol |
| Monoisotopic Mass | 561.88988 g/mol |
| Topological Polar Surface Area | 72.4 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 594 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |