956574-60-0
Product Name:
DIETHYL 2-(([1-(4-CHLOROPHENYL)-3-METHYL-1H-PYRAZOL-5-YL]AMINO)METHYLENE)MALONATE
Formula:
C18H20ClN3O4
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COMPUTED DESCRIPTORS
Molecular Weight | 377.8 g/mol |
---|---|
XLogP3 | 4.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 9 |
Exact Mass | 377.1142338 g/mol |
Monoisotopic Mass | 377.1142338 g/mol |
Topological Polar Surface Area | 82.4 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 501 |
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 |