SMILES:
Clc1cc2c(NCCc3ccc4c(c3)OCO4)nc(-c3ccccn3)nc2s1Molecular Processing
Molecular formula
C20H15ClN4O2S
Molecular weight
410.89
Exact mass
410.0604
XLogP
4.79
TPSA
69.16
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
110.41
Supplementary Information
Details werden geladen…
An 5 Reaktionen beteiligt→