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N-[3-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)phenyl]-3-(trifluoromethyl)benzamide

HCID 57749146
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Basic information

Standard SMILES
O=C(Nc1cccc(Oc2ccc3nc(NC(=O)C4CC4)nn3c2)c1)c1cccc(C(F)(F)F)c1
InChIKey
DALWRMIXEBYJNX-UHFFFAOYSA-N
Molecular formula
C24H18F3N5O3
Average molar mass
481.4 g/mol

Names & identifiers

Preferred name
N-[3-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)phenyl]-3-(trifluoromethyl)benzamide
IUPAC
N-[3-[[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]oxy]phenyl]-3-(trifluoromethyl)benzamide

Names & synonyms

N-[3-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)phenyl]-3-(trifluoromethyl)benzamideSCHEMBL2856102

Database identifiers

PubChem CID
57749146

Properties

Computed structural properties

XLogP
4
Topological polar surface area
97.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
35
Formal charge
0
Complexity
780

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Related reactions

3 records
New reaction record
HRID 97352 reaction equation
HRID 97352As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1800395 reaction equation
HRID 1800395As productuspto-grants-2013_01
HRID 1874581 reaction equation
HRID 1874581As productuspto-grants-2012_11

Compound notes

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