Cc1oc(-c2ccccc2)nc1CCOc1ccc(C=CC=CC=O)cc1
名称: 5-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]penta-2,4-dienal
SMILES: Cc1oc(-c2ccccc2)nc1CCOc1ccc(C=CC=CC=O)cc1

Molecular Processing

Molecular formula
C23H21NO3
Molecular weight
359.43
Exact mass
359.1521
XLogP
5.04
TPSA
52.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
106.56

Supplementary Information

InChIKey: MQXCZMBALDZNAT-UHFFFAOYSA-N
同義語
SCHEMBL7161623
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