C1=CC=NC(=C1)C2=CN(N=N2)C3=CC=C(C=C3)NC4=NC=C(N5C4=NC=C5)Br
Name: 5-bromo-N-[4-(4-pyridin-2-yltriazol-1-yl)phenyl]imidazo[1,2-a]pyrazin-8-amine
SMILES: C1=CC=NC(=C1)C2=CN(N=N2)C3=CC=C(C=C3)NC4=NC=C(N5C4=NC=C5)Br

Molecular Processing

Molecular formula
C19H13BrN8
Molecular weight
433.27
Exact mass
432.0447
XLogP
3.88
TPSA
85.82
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
28
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
108.56

Supplementary Information

InChIKey: PQTNLIUPYRROAF-UHFFFAOYSA-N
Synonyme
SCHEMBL1674252PQTNLIUPYRROAF-UHFFFAOYSA-N(5-bromo-imidazo[1,2-a]pyrazin-8-yl)-[4-(4-pyridin-2-yl-[1,2,3]triazol-1-yl)-phenyl]-amine(5-Bromo-imidazo[1,2-a]pyrazin-8-yl)-[4-(4-pyridin-2-yl-[1,2,3]triazol-1-yl)-phenyl]amine
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