Nc1ccc(Cl)cc1C(=O)c1ccncn1
Name: (2-Amino-5-chloro-phenyl)-pyrimidin-4-yl-methanone
SMILES: Nc1ccc(Cl)cc1C(=O)c1ccncn1

Molecular Processing

Molecular formula
C11H8ClN3O
Molecular weight
233.66
Exact mass
233.0356
XLogP
1.94
TPSA
68.87
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
61.33

Supplementary Information

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