75989-96-7
Product Name:
ETHYL 4-(BENZOYLAMINO)-2-CYANO-3-HYDROXY-5-PHENYL-2,4-PENTADIENOATE
Formula:
C21H18N2O4
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COMPUTED DESCRIPTORS
Molecular Weight | 362.4 g/mol |
---|---|
XLogP3 | 3.8 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 7 |
Exact Mass | 362.12665706 g/mol |
Monoisotopic Mass | 362.12665706 g/mol |
Topological Polar Surface Area | 99.4 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 644 |
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 |