Name: N-{1-[4-[2-(difluoromethyl)-4-methoxy-1H-benzimidazol-1-yl]-6-(4-morpholinyl)-1,3,5-triazin-2-yl]-3-azetidinyl}methanesulfonamide
SMILES:
COc1cccc2c1nc(C(F)F)n2-c1nc(N2CCOCC2)nc(N2CC(NS(C)(=O)=O)C2)n1Molecular Processing
Molecular formula
C20H24F2N8O4S
Molecular weight
510.53
Exact mass
510.1609
XLogP
0.73
TPSA
127.6
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
7
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
122.98
Supplementary Information
Details werden geladen…
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