C1=CC(=CC=C1C2=NC(=C(C=C2)C#N)Cl)N
Nom: 6-(4-aminophenyl)-2-chloropyridine-3-carbonitrile
SMILES: C1=CC(=CC=C1C2=NC(=C(C=C2)C#N)Cl)N

Molecular Processing

Molecular formula
C12H8ClN3
Molecular weight
229.67
Exact mass
229.0407
XLogP
2.86
TPSA
62.7
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
63.81

Supplementary Information

InChIKey: REMDCXQIXPMWSG-UHFFFAOYSA-N
Synonymes
6-(4-aminophenyl)-2-chloronicotinonitrileSCHEMBL1323377REMDCXQIXPMWSG-UHFFFAOYSA-N
Voir la source →
Impliqué dans 5 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→