425396-09-4
Product Name:
4-[2-(3-FLUOROPHENYL)-4-HYDROXY-3-(4-METHYLBENZOYL)-5-OXO-2,5-DIHYDRO-1H-PYRROL-1-YL]BUTANOIC ACID
Formula:
C22H20FNO5
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COMPUTED DESCRIPTORS
Molecular Weight | 397.4 g/mol |
---|---|
XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 6 |
Exact Mass | 397.13255090 g/mol |
Monoisotopic Mass | 397.13255090 g/mol |
Topological Polar Surface Area | 94.9 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 683 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |