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1-[3-[(3R)-1-acetylpiperidin-3-yl]oxy-5-fluorophenyl]-3-phenylurea;1-[(3R)-3-(3-amino-5-fluorophenoxy)piperidin-1-yl]ethanone;azane;N-[fluoro(oxo)-lambda5-chloranylidene]nitrous amide;hexa-1,3,5-triyn-1-ol;3-isocyanatopyridine;methane;molecular hydrogen;trideca-1,3,5,7,9,11-hexayne;hydrochloride

HCID 160051568
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
No structure available

Basic information

InChIKey
OOIVAVCPNQWQAC-JRGDYFPGSA-N
Molecular formula
C59H74Cl2F3N11O9
Average molar mass
1,209.2 g/mol

Names & identifiers

Preferred name
1-[3-[(3R)-1-acetylpiperidin-3-yl]oxy-5-fluorophenyl]-3-phenylurea;1-[(3R)-3-(3-amino-5-fluorophenoxy)piperidin-1-yl]ethanone;azane;N-[fluoro(oxo)-lambda5-chloranylidene]nitrous amide;hexa-1,3,5-triyn-1-ol;3-isocyanatopyridine;methane;molecular hydrogen;trideca-1,3,5,7,9,11-hexayne;hydrochloride
IUPAC
1-[3-[(3R)-1-acetylpiperidin-3-yl]oxy-5-fluorophenyl]-3-phenylurea;1-[(3R)-3-(3-amino-5-fluorophenoxy)piperidin-1-yl]ethanone;azane;N-[fluoro(oxo)-λ5-chloranylidene]nitrous amide;hexa-1,3,5-triyn-1-ol;3-isocyanatopyridine;methane;molecular hydrogen;trideca-1,3,5,7,9,11-hexayne;hydrochloride

Database identifiers

PubChem CID
160051568

Properties

Computed structural propertiesFilling in

Topological polar surface area
250 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
19
Rotatable bonds
14
Heavy atoms
84
Formal charge
0
Complexity
1,830

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