319492-96-1
Product Name:
7-ISOPROPOXY-6-METHOXY-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBONITRILE
Formula:
C14H14N2O3
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COMPUTED DESCRIPTORS
Molecular Weight | 258.27 g/mol |
---|---|
XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
Exact Mass | 258.10044231 g/mol |
Monoisotopic Mass | 258.10044231 g/mol |
Topological Polar Surface Area | 71.4 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 435 |
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 |