338748-62-2
Product Name:
2-(4-[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]PIPERAZINO)ETHYL 3-(TRIFLUOROMETHYL)BENZENECARBOXYLATE
Formula:
C21H19F6N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 491.4 g/mol |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 6 |
| Exact Mass | 491.12797507 g/mol |
| Monoisotopic Mass | 491.12797507 g/mol |
| Topological Polar Surface Area | 78.6 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 706 |
| 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 |