O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)c1ccc(F)cc1
SMILES: O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)c1ccc(F)cc1

Molecular Processing

Molecular formula
C19H16BrFN2O
Molecular weight
387.25
Exact mass
386.043
XLogP
4.88
TPSA
44.89
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
95.54

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt