SMILES:
COC(=O)CCSc1cnc(NC(=O)N(C2CCCCC2)C2CCC(C(F)(F)F)CC2)s1Molecular Processing
Molecular formula
C21H30F3N3O3S2
Molecular weight
493.62
Exact mass
493.1681
XLogP
6.09
TPSA
71.53
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
32
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.762
Molar refractivity
119
Supplementary Information
Récupération des détails…
Impliqué dans 6 réactions→