Name: N-(4-(6-nitroquinolin-4-ylthio)phenyl)-4-phenylphthalazin-1-amine
SMILES:
O=[N+]([O-])c1ccc2nccc(Sc3ccc(Nc4nnc(-c5ccccc5)c5ccccc45)cc3)c2c1Molecular Processing
Molecular formula
C29H19N5O2S
Molecular weight
501.57
Exact mass
501.1259
XLogP
7.65
TPSA
93.84
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
37
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0
Molar refractivity
147.22
Supplementary Information
Details werden geladen…
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