Name: 2-(4-cyano-2-fluoro-5-(3-methylisothiazol-5-ylamino)phenylamino)-4,4,4-trifluorobutanamide
SMILES:
Cc1cc(Nc2cc(NC(CC(F)(F)F)C(N)=O)c(F)cc2C#N)sn1Molecular Processing
Molecular formula
C15H13F4N5OS
Molecular weight
387.36
Exact mass
387.0777
XLogP
3.42
TPSA
103.83
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
88.53
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→