SMILES:
CC(C)(C)OC(=O)N1CC(=O)N(c2ccc(N3CC(CNC(=O)c4ccc(Cl)s4)OC3=O)cc2)C(=O)C1Molecular Processing
Molecular formula
C24H25ClN4O7S
Molecular weight
549.01
Exact mass
548.1132
XLogP
3.27
TPSA
125.56
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
136.02
Supplementary Information
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