Name: (5-(4-(bis(4-methoxybenzyl)amino)-6-methyl-1,3,5-triazin-2-yl)-6-(6-methoxypyridin-3-ylamino)pyridin-3-yl)methyl methanesulfonate
SMILES:
COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(-c3cc(COS(C)(=O)=O)cnc3Nc3ccc(OC)nc3)n2)cc1Molecular Processing
Molecular formula
C33H35N7O6S
Molecular weight
657.75
Exact mass
657.237
XLogP
5.09
TPSA
150.78
H-bond donors
1
H-bond acceptors
13
Rotatable bonds
14
Heavy atoms
47
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.242
Molar refractivity
177.37
Supplementary Information
Details werden geladen…
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