SMILES:
Cc1snc2c1C(=O)N=C(N)NCc1cc(Cl)c(c(Cl)c1)NC(=O)CN(Cc1ccccc1)CCCC=CCOc1ccc-2cc1Molecular Processing
Molecular formula
C34H34Cl2N6O3S
Molecular weight
677.66
Exact mass
676.179
XLogP
6.84
TPSA
121.94
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
2
Heavy atoms
46
Rings
8
Aromatic rings
4
Saturated rings
0
Aliphatic rings
4
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
185.76
Supplementary Information
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