SMILES:
N#CC1(NC(=O)C2CC(S(=O)(=O)c3ccc(F)cc3Cl)CC2CO)CC1Molecular Processing
Molecular formula
C17H18ClFN2O4S
Molecular weight
400.86
Exact mass
400.066
XLogP
1.81
TPSA
107.26
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
91.4
Supplementary Information
Details werden geladen…
An 6 Reaktionen beteiligt→