4-Amino-2-butyl-1-(2-hydroxy-2-methylpropyl)-7-methoxycarbonyl-1H-imidazo[4,5-c]quinoline

HCID 71284052
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCc1nc2c(N)nc3cc(C(=O)OC)ccc3c2n1CC(C)(C)O
InChIKey
VMUKZTRCWGVBDU-UHFFFAOYSA-N
Molecular formula
C20H26N4O3
Average molar mass
370.4 g/mol
Monoisotopic mass
370.2004907

Names & identifiers

Preferred name
4-Amino-2-butyl-1-(2-hydroxy-2-methylpropyl)-7-methoxycarbonyl-1H-imidazo[4,5-c]quinoline
IUPAC
methyl 4-amino-2-butyl-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinoline-7-carboxylate

Names & synonyms

CHEMBL2216760SCHEMBL14744577VMUKZTRCWGVBDU-UHFFFAOYSA-NBDBM504030224-Amino-2-butyl-1-(2-hydroxy-2-methylpropyl)-7-methoxycarbonyl-1H-imidazo[4,5-c]quinoline

Database identifiers

PubChem CID
71284052
ChEMBL
CHEMBL2216760
Nikkaji
J3.367.704I

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
103 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
27

Related reactions

2 records
New reaction record

Compound notes

Loading…