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Methyl 2-(4-(7-(bis((2-(trimethylsilyl)ethoxy)methyl)amino)-6-bromo-3-(quinolin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yloxy)phenyl)acetate

HCID 67494646
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)Cc1ccc(Oc2nc3c(-c4cnc5ccccc5c4)cnn3c(N(COCC[Si](C)(C)C)COCC[Si](C)(C)C)c2Br)cc1
InChIKey
BRVVRMGRRCGTSO-UHFFFAOYSA-N
Molecular formula
C36H46BrN5O5Si2
Average molar mass
764.9 g/mol

Names & identifiers

Preferred name
Methyl 2-(4-(7-(bis((2-(trimethylsilyl)ethoxy)methyl)amino)-6-bromo-3-(quinolin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yloxy)phenyl)acetate
IUPAC
methyl 2-[4-[7-[bis(2-trimethylsilylethoxymethyl)amino]-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl]oxyphenyl]acetate

Names & synonyms

SCHEMBL2680440BRVVRMGRRCGTSO-UHFFFAOYSA-Nmethyl 2-(4-(7-(bis((2-(trimethylsilyl)ethoxy)methyl)amino)-6-bromo-3-(quinolin-3-yl)pyrazolo[1,5-a]pyrimidin-5-yloxy)phenyl)acetate

Database identifiers

PubChem CID
67494646

Properties

Computed structural properties

Topological polar surface area
100 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
17
Heavy atoms
49
Formal charge
0
Complexity
1,010

Related reactions

4 records
New reaction record
HRID 159988 reaction equation
HRID 159988As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1152366 reaction equation
HRID 1152366As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 2047031 reaction equation
HRID 2047031As productuspto-grants-2013_11
HRID 2047032 reaction equation
HRID 2047032As reactantuspto-grants-2013_11

Compound notes

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