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6-({5-[2-(ethylamino)ethoxy]pyridin-2-yl}oxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)quinazoline-4-amine

HCID 59508905
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCNCCOc1ccc(Oc2ccc3ncnc(Nc4nc(C)ns4)c3c2)nc1
InChIKey
GCLWCKOIDAGESL-UHFFFAOYSA-N
Molecular formula
C20H21N7O2S
Average molar mass
423.5 g/mol

Names & identifiers

Preferred name
6-({5-[2-(ethylamino)ethoxy]pyridin-2-yl}oxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)quinazoline-4-amine
IUPAC
N-[6-[[5-[2-(ethylamino)ethoxy]-2-pyridinyl]oxy]quinazolin-4-yl]-3-methyl-1,2,4-thiadiazol-5-amine

Names & synonyms

SCHEMBL2889637GCLWCKOIDAGESL-UHFFFAOYSA-N6-({5-[2-(ethylamino)ethoxy]pyridin-2-yl}oxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)quinazoline-4-amine

Database identifiers

PubChem CID
59508905

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
135 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
9
Heavy atoms
30
Formal charge
0
Complexity
520

Related reactions

3 records
New reaction record
HRID 81661 reaction equation
HRID 81661As productuspto-grants-2014_09
HRID 1126316 reaction equation
HRID 1126316As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1517300 reaction equation
HRID 1517300As productuspto-grants-2012_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes