Name: 2-phenyl-ethenesulfonic acid [6-(2-hydroxy-ethoxy)-5-p-tolyl-pyrimidin-4-yl]-amide
SMILES:
Cc1ccc(-c2c(NS(=O)(=O)C=Cc3ccccc3)ncnc2OCCO)cc1Molecular Processing
Molecular formula
C21H21N3O4S
Molecular weight
411.48
Exact mass
411.1253
XLogP
3.24
TPSA
101.41
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
112.8
Supplementary Information
Details werden geladen…
An 7 Reaktionen beteiligt→