N-(4-methoxybenzyl)-3-morpholino-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinolin-2-amine

HCID 71253458
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Basic information

Standard SMILES
COc1ccc(CNc2nc3ccc(B4OC(C)(C)C(C)(C)O4)cc3cc2N2CCOCC2)cc1
InChIKey
ZOCDUTZHNUFEPJ-UHFFFAOYSA-N
Molecular formula
C27H34BN3O4
Average molar mass
475.4 g/mol

Names & identifiers

Preferred name
N-(4-methoxybenzyl)-3-morpholino-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinolin-2-amine
IUPAC
N-[(4-methoxyphenyl)methyl]-3-morpholin-4-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinolin-2-amine

Names & synonyms

SCHEMBL14688581ZOCDUTZHNUFEPJ-UHFFFAOYSA-NN-(4-methoxybenzyl)-3-morpholino-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinolin-2-amine

Database identifiers

PubChem CID
71253458

Properties

Computed structural properties

Topological polar surface area
65.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
35

Related reactions

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Compound notes

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