338415-44-4
Product Name:
2-(4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]PIPERAZINO)ETHYL 4-METHYLBENZENECARBOXYLATE
Formula:
C20H21ClF3N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 427.8 g/mol |
---|---|
XLogP3 | 4.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 6 |
Exact Mass | 427.1274391 g/mol |
Monoisotopic Mass | 427.1274391 g/mol |
Topological Polar Surface Area | 45.7 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 536 |
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 |