HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

4-bis(phenylmethyl)amino-1-ethoxymethyl-1H-imidazo[4,5-c]quinolin-2-methanol

HCID 18995665
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOCn1c(CO)nc2c(N(Cc3ccccc3)Cc3ccccc3)nc3ccccc3c21
InChIKey
ZABNVWZCJRFGNQ-UHFFFAOYSA-N
Molecular formula
C28H28N4O2
Average molar mass
452.5 g/mol
Monoisotopic mass
452.22122615

Names & identifiers

Preferred name
4-bis(phenylmethyl)amino-1-ethoxymethyl-1H-imidazo[4,5-c]quinolin-2-methanol
IUPAC
[4-(dibenzylamino)-1-(ethoxymethyl)imidazo[4,5-c]quinolin-2-yl]methanol

Names & synonyms

SCHEMBL8130319ZABNVWZCJRFGNQ-UHFFFAOYSA-N4-bis(phenylmethyl)amino-1-ethoxymethyl-1H-imidazo[4,5-c]quinolin-2-methanol

Database identifiers

PubChem CID
18995665

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
63.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
34
Formal charge
0
Complexity
589

Related reactions

2 records
New reaction record
HRID 169815 reaction equation
HRID 169815As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 374986 reaction equation
HRID 374986As productuspto-grants-1996_01

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes