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

HCID 57749161
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ncsc1C(=O)Nc1cccc(Oc2ccc3nc(NC(=O)C4CC4)nn3c2)c1
InChIKey
BZGNITJANUXYDT-UHFFFAOYSA-N
Molecular formula
C21H18N6O3S
Average molar mass
434.5 g/mol
Monoisotopic mass
434.11610963

Names & identifiers

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

Names & synonyms

SCHEMBL4280391BZGNITJANUXYDT-UHFFFAOYSA-NN-[3-({2-[(cyclopropylcarbonyl)amino][1,2,4]triazolo[1,5-a]pyridin-6-yl}oxy)phenyl]-4-methyl-1,3-thiazole-5-carboxamide

Database identifiers

PubChem CID
57749161

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
139 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
31
Formal charge
0
Complexity
680

Related reactions

2 records
New reaction record
HRID 815505 reaction equation
HRID 815505As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1874447 reaction equation
HRID 1874447As productuspto-grants-2012_11

Compound notes

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