COc1ccc(Cl)cc1C(=O)n1ccnc1
名称: (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone
SMILES: COc1ccc(Cl)cc1C(=O)n1ccnc1

Molecular Processing

Molecular formula
C11H9ClN2O2
Molecular weight
236.66
Exact mass
236.0353
XLogP
2.23
TPSA
44.12
H-bond donors
0
H-bond acceptors
3
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
0.091
Molar refractivity
59.96

Supplementary Information

InChIKey: CWWPHXFFHATZJM-UHFFFAOYSA-N
同義語
SCHEMBL4286867CWWPHXFFHATZJM-UHFFFAOYSA-N(5-chloro-2-methoxy-phenyl)-imidazol-1-yl-methanone
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