RefChem:1097855 structure

RefChem:1097855

(E)-but-2-enedioic acid;4-[3-[(3S,4R)-3-ethylpiperidin-4-yl]propyl]-6-methoxyquinoline

Also Known As: 4(R)-(3-(6-Methoxy 4-quinolyl)propyl) 3(S)-ethyl piperidine fumarate|quinoline,4-(3-6-methoxy-, -, -2-butenedioate|Quinoline,4-(3- -6-methoxy-, -, -2-butenedioate|Quinoline, 4-(3-(3-ethyl-4-piperidinyl)propyl)-6-methoxy-, (3S-trans)-, (E)-2-butenedioate (1:1)|(E)-but-2-enedioic acid,4-[3-[(3S,4R)-3-ethylpiperidin-4-yl]propyl]-6-methoxyquinoline|(E)-but-2-enedioic acid; 4-[3-[(3S,4R)-3-ethylpiperidin-4-yl]propyl]-6-methoxyquinoline

CAS: 77167-87-4
Molecular Formula C24H32N2O5
Molecular Weight 428.2311 g/mol
LogP 3.9136
Topological Polar Surface Area 108.75 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 428.2311
Monoisotopic Mass 428.2311
Heavy Atoms 31
Complexity 880.6687

Chemical Identifiers

CAS Number 77167-87-4
SMILES CC[C@@H]1CNCC[C@H]1CCCC2=C3C=C(C=CC3=NC=C2)OC.C(=C/C(=O)O)\C(=O)O

Product Overview

RefChem:1097855 (CAS 77167-87-4), with molecular formula C24H32N2O5 and molecular weight 428.2311 g/mol. IUPAC: (E)-but-2-enedioic acid;4-[3-[(3S,4R)-3-ethylpiperidin-4-yl]propyl]-6-methoxyquinoline.

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