Name: 4-t-butyl-N-[6-chloro-2-(4,6-dimethoxy-2-pyrimidinyl)-5-(2-methoxyphenoxy)-4-pyrimidinyl]-benzenesulfonamide
SMILES:
COc1cc(OC)nc(-c2nc(Cl)c(Oc3ccccc3OC)c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)n2)n1Molecular Processing
Molecular formula
C27H28ClN5O6S
Molecular weight
586.07
Exact mass
585.1449
XLogP
5.5
TPSA
134.65
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
9
Heavy atoms
40
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.259
Molar refractivity
150.19
Supplementary Information
Details werden geladen…
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