COc1ccc(-c2c3cccc(F)c3nn2CC(C)C)c(OC)c1
Name: 3-(2,4-dimethoxyphenyl)-7-fluoro-2-isobutyl-2H-indazole
SMILES: COc1ccc(-c2c3cccc(F)c3nn2CC(C)C)c(OC)c1

Molecular Processing

Molecular formula
C19H21FN2O2
Molecular weight
328.39
Exact mass
328.1587
XLogP
4.52
TPSA
36.28
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
93.07

Supplementary Information

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