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Quinoline, 2-(4-(3-indolylmethyl)-1-piperazinyl)-, dimaleate

HCID 6447435
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Basic information

CAS
75410-87-6
Standard SMILES
O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O.c1ccc2nc(N3CCN(Cc4c[nH]c5ccccc45)CC3)ccc2c1
InChIKey
INMCDUCTFZHWNP-LVEZLNDCSA-N
Molecular formula
C30H30N4O8
Average molar mass
574.6 g/mol
Monoisotopic mass
574.20636393

Names & identifiers

Preferred name
Quinoline, 2-(4-(3-indolylmethyl)-1-piperazinyl)-, dimaleate
IUPAC
bis((E)-but-2-enedioic acid);2-[4-(1H-indol-3-ylmethyl)piperazin-1-yl]quinoline

Names & synonyms

Quinoline, 2-(4-(3-indolylmethyl)-1-piperazinyl)-, dimaleate75410-87-6RefChem:10978421-(3'-Indolylmethyl)-4-(2'-quinolyl)piperazine dimaleate

Database identifiers

CAS
75410-87-6
PubChem CID
6447435

Properties

Computed structural properties

Topological polar surface area
184 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
11
Rotatable bonds
7
Heavy atoms
42
Formal charge
0
Complexity
580

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