Nom: product
SMILES:
Cn1nc(/C=C/C2=C(Cl)CC3CCC(C2)/C3=N/S(=O)C(C)(C)C)cc1-c1ccc(F)cc1Molecular Processing
Molecular formula
C25H29ClFN3OS
Molecular weight
474.05
Exact mass
473.1704
XLogP
6.46
TPSA
47.25
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
131.29
Supplementary Information
No supplementary data available
Impliqué dans 2 réactions→