1217766-70-5
Product Name:
2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone
Formula:
C26H28Cl2N4O4
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COMPUTED DESCRIPTORS
Molecular Weight | 534.4 g/mol |
---|---|
XLogP3 | 4.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 7 |
Exact Mass | 533.1675910 g/mol |
Monoisotopic Mass | 533.1675910 g/mol |
Topological Polar Surface Area | 69.1 Ų |
Heavy Atom Count | 36 |
Formal Charge | 0 |
Complexity | 735 |
Isotope Atom Count | 3 |
Defined Atom Stereocenter Count | 2 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |