CNC1=NC=CC(=C1)C2=C(N=CC=C2)OC3=CC=C(C=C3)N
CAS: 1004549-24-9
Name: 4-[2-(4-aminophenoxy)-3-pyridinyl]-N-methylpyridin-2-amine
SMILES: CNC1=NC=CC(=C1)C2=C(N=CC=C2)OC3=CC=C(C=C3)N

Molecular Processing

Molecular formula
C17H16N4O
Molecular weight
292.34
Exact mass
292.1324
XLogP
3.56
TPSA
73.06
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
87.94

Supplementary Information

InChIKey: DDKVRNJBBNFMOC-UHFFFAOYSA-N
Synonyme
4-(2-(4-aminophenoxy)pyridin-3-yl)-N-methylpyridin-2-amine1004549-24-9SCHEMBL587790DDKVRNJBBNFMOC-UHFFFAOYSA-NDB-294553
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