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2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-((R)-pyrrolidin-3-yl)acetamide

HCID 11950342
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(COc1cccc(-c2nc(Nc3ccc4[nH]ncc4c3)c3ccccc3n2)c1)N[C@@H]1CCNC1
InChIKey
JGWIJSLXUUPLIV-HXUWFJFHSA-N
Molecular formula
C27H25N7O2
Average molar mass
479.5 g/mol

Names & identifiers

Preferred name
2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-((R)-pyrrolidin-3-yl)acetamide
IUPAC
2-[3-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]phenoxy]-N-[(3R)-pyrrolidin-3-yl]acetamide

Names & synonyms

SCHEMBL1724076JGWIJSLXUUPLIV-HXUWFJFHSA-N2-(3-(4-(1H-indazol-5-ylamino)quinazolin-2-yl)phenoxy)-N-((R)-pyrrolidin-3-yl)acetamide

Database identifiers

PubChem CID
11950342

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
117 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
36
Formal charge
0
Complexity
741

Related reactions

3 records
New reaction record
HRID 61587 reaction equation
HRID 61587As productuspto-grants-2016_09
HRID 1406938 reaction equation
HRID 1406938As productuspto-grants-2014_12
HRID 1808449 reaction equation
HRID 1808449As productuspto-grants-2013_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes