chempirical

5-[4-[(1,1-Dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C17H19N5O2SCAS 1257705-09-1357.43 g/mol

Open in Covalent MOL file
SOONNNNNH2
Primary amineSulfoneTertiary amine

Properties

Molecular formula
C17H19N5O2S
Molar mass
357.43 g/mol
Exact mass
357.1259 Da
logP
1.21Crippen estimate
Polar surface area
93.6 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
3

Identifiers

CAS number
1257705-09-1
SMILES
C1CS(=O)(=O)CCN1CC2=CC=C(C=C2)C3=CC=CC4=NC(=NN43)N
InChIKey
BYWJAVQGRJEEHH-UHFFFAOYSA-N
InChI
InChI=1S/C17H19N5O2S/c18-17-19-16-3-1-2-15(22(16)20-17)14-6-4-13(5-7-14)12-21-8-10-25(23,24)11-9-21/h1-7H,8-12H2,(H2,18,20)

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Names and synonyms

1 names
  • [1,2,4]Triazolo[1,5-A]pyridin-2-amine, 5-[4-[(1,1-dioxido-4-thiomorpholinyl)methyl]phenyl]-

Work with 5-[4-[(1,1-Dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

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Similar compounds

Filgotinib1206101-20-362 % similar Filgotinib1206161-97-849 % similar 5-Bromo-[1,2,4]triazolo[1,5-A]pyridin-2-ylamine1010120-55-438 % similar 4-[4-(4,4,5,5-Tetramethyl[1,3,2]dioxaborolan-2-yl)benzyl]thiomorpholine 1,1-dioxide1092563-25-136 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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