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N-(5-(3,5-dimethyl-1H-pyrazol-4-yl)thiazolo[5,4-b]pyridin-2-yl)-4-(2-hydroxypropan-2-yl)benzamide

HCID 44549075
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Basic information

Standard SMILES
Cc1n[nH]c(C)c1-c1ccc2nc(NC(=O)c3ccc(C(C)(C)O)cc3)sc2n1
InChIKey
QTBBWWDVLNGASW-UHFFFAOYSA-N
Molecular formula
C21H21N5O2S
Average molar mass
407.5 g/mol

Names & identifiers

Preferred name
N-(5-(3,5-dimethyl-1H-pyrazol-4-yl)thiazolo[5,4-b]pyridin-2-yl)-4-(2-hydroxypropan-2-yl)benzamide
IUPAC
N-[5-(3,5-dimethyl-1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]-4-(2-hydroxypropan-2-yl)benzamide

Names & synonyms

SCHEMBL2743799QTBBWWDVLNGASW-UHFFFAOYSA-NN-(5-(3,5-dimethyl-1H-pyrazol-4-yl)thiazolo[5,4-b]pyridin-2-yl)-4-(2-hydroxypropan-2-yl)benzamide

Database identifiers

PubChem CID
44549075

Properties

Computed structural propertiesFilling in

XLogP
3.3
Topological polar surface area
132 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Formal charge
0
Complexity
598

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Related reactions

2 records
New reaction record
HRID 1134829 reaction equation
HRID 1134829As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1924769 reaction equation
HRID 1924769As productuspto-grants-2012_05

Compound notes

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