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Tert-butyl 3-(4-amino-2-(2-methoxyethyl)-1h-imidazo[4,5-c]quinolin-1-yl)propylcarbamate

HCID 10318754
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COCCc1nc2c(N)nc3ccccc3c2n1CCCNC(=O)OC(C)(C)C
InChIKey
YNWSAOYTOOEOBD-UHFFFAOYSA-N
Molecular formula
C21H29N5O3
Average molar mass
399.5 g/mol
Monoisotopic mass
399.2270398

Names & identifiers

Preferred name
Tert-butyl 3-(4-amino-2-(2-methoxyethyl)-1h-imidazo[4,5-c]quinolin-1-yl)propylcarbamate
IUPAC
tert-butyl N-[3-[4-amino-2-(2-methoxyethyl)imidazo[4,5-c]quinolin-1-yl]propyl]carbamate

Names & synonyms

tert-butyl 3-(4-amino-2-(2-methoxyethyl)-1h-imidazo[4,5-c]quinolin-1-yl)propylcarbamateTert-Butyl 3-[4-amino-2-(2-methoxyethyl)-1H-imidazo[4,5-c]quinolin-1-yl]propylcarbamateSCHEMBL5355094YNWSAOYTOOEOBD-UHFFFAOYSA-N908368-40-1DB-299100

Database identifiers

PubChem CID
10318754

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
104 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
29
Formal charge
0
Complexity
541

Related reactions

3 records
New reaction record
HRID 81884 reaction equation
HRID 81884As reactantuspto-grants-2014_09
HRID 952622 reaction equation
HRID 952622As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1925459 reaction equation
HRID 1925459As reactantuspto-grants-2012_05

Compound notes

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