Name: 6-(1-Ethoxyvinyl)-2-(dimethylamino)-7-fluoro-5-methyl-1,3-benzoxazole-4-carbonitrile
SMILES:
C=C(OCC)c1c(C)c(C#N)c2nc(N(C)C)oc2c1FMolecular Processing
Molecular formula
C15H16FN3O2
Molecular weight
289.31
Exact mass
289.1227
XLogP
3.22
TPSA
62.29
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
78.41
Supplementary Information
Details werden geladen…
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