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N-[4-(4-amino-2-phenyl-1H-imidazo[4,5-c]quinolin-1-yl)butyl]-N'-propylthiourea

HCID 9954525
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCNC(=S)NCCCCn1c(-c2ccccc2)nc2c(N)nc3ccccc3c21
InChIKey
CXQDGBXZCFCKSP-UHFFFAOYSA-N
Molecular formula
C24H28N6S
Average molar mass
432.6 g/mol

Names & identifiers

Preferred name
N-[4-(4-amino-2-phenyl-1H-imidazo[4,5-c]quinolin-1-yl)butyl]-N'-propylthiourea
IUPAC
1-[4-(4-amino-2-phenylimidazo[4,5-c]quinolin-1-yl)butyl]-3-propylthiourea

Names & synonyms

SCHEMBL5347638CXQDGBXZCFCKSP-UHFFFAOYSA-NN-[4-(4-amino-2-phenyl-1H-imidazo[4,5-c]quinolin-1-yl)butyl]-N'-propylthiourea

Database identifiers

PubChem CID
9954525

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
113 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
31
Formal charge
0
Complexity
568

Related reactions

7 records
New reaction record
HRID 175967 reaction equation
HRID 175967As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1263506 reaction equation
HRID 1263506As productuspto-grants-2003_04
HRID 1368127 reaction equation
HRID 1368127As productuspto-grants-2003_06
HRID 1371309 reaction equation
HRID 1371309As productuspto-grants-2007_01
HRID 1837020 reaction equation
HRID 1837020As productuspto-grants-2004_08
HRID 1837563 reaction equation
HRID 1837563As productuspto-grants-2004_08
HRID 2182291 reaction equation
HRID 2182291As productuspto-grants-2005_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes