306976-63-6
Product Name:
METHYL 3-AMINO-1-CYANO-4-FLUORO-1-(2-THIENYL)-1H-INDENE-2-CARBOXYLATE
Formula:
C16H11FN2O2S
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COMPUTED DESCRIPTORS
Molecular Weight | 314.3 g/mol |
---|---|
XLogP3 | 2.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 3 |
Exact Mass | 314.05252693 g/mol |
Monoisotopic Mass | 314.05252693 g/mol |
Topological Polar Surface Area | 104 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 570 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |