338406-34-1
Product Name:
DIETHYL 4-(AMINO[4-(4-CHLOROPHENYL)PIPERAZINO]METHYLENE)-2-CYANO-2-PENTENEDIOATE
Formula:
C21H25ClN4O4
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COMPUTED DESCRIPTORS
Molecular Weight | 432.9 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 9 |
Exact Mass | 432.1564330 g/mol |
Monoisotopic Mass | 432.1564330 g/mol |
Topological Polar Surface Area | 109 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 727 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 2 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |