CCCCC(=O)Nc1cccc(-n2nc(CCCC)n(Cc3ccc(-c4ccccc4S(=O)(=O)NC(=O)c4ccccc4Cl)cc3)c2=O)c1
SMILES: CCCCC(=O)Nc1cccc(-n2nc(CCCC)n(Cc3ccc(-c4ccccc4S(=O)(=O)NC(=O)c4ccccc4Cl)cc3)c2=O)c1

Molecular Processing

Molecular formula
C37H38ClN5O5S
Molecular weight
700.26
Exact mass
699.2282
XLogP
6.99
TPSA
132.16
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
14
Heavy atoms
49
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.243
Molar refractivity
191.67

Supplementary Information

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