338749-77-2
Product Name:
1-(1-[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]-2-METHYL-5-[4-(METHYLSULFONYL)PHENYL]-1H-PYRROL-3-YL)-2,2,2-TRIFLUORO-1-ETHANONE
Formula:
C21H14ClF6NO3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 509.8 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 509.0287111 g/mol |
| Monoisotopic Mass | 509.0287111 g/mol |
| Topological Polar Surface Area | 64.5 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 819 |
| 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 |