CC1=NC=CC(=C1)C(=O)C2=C(C=CC(=C2)Cl)N
CAS: 698395-59-4
Name: (2-amino-5-chlorophenyl)-(2-methyl-4-pyridinyl)methanone
SMILES: CC1=NC=CC(=C1)C(=O)C2=C(C=CC(=C2)Cl)N

Molecular Processing

Molecular formula
C13H11ClN2O
Molecular weight
246.7
Exact mass
246.056
XLogP
2.86
TPSA
55.98
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
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
0.077
Molar refractivity
68.27

Supplementary Information

InChIKey: YEVADSZMEBMWOU-UHFFFAOYSA-N
Synonyme
698395-59-4SCHEMBL343605YEVADSZMEBMWOU-UHFFFAOYSA-NDB-388748(2-Amino-5-chlorophenyl)(2-methyl-4-pyridinyl)methanone(2-Amino-5-chloro-phenyl)-(2-methyl-pyridin-4-yl)-methanone
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