CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(S(=O)(=O)NCCOCCOCCOCCNC(=O)NCCCCNC(=O)NCCOCCOCCOCCNS(=O)(=O)c3cccc(C4CN(C)Cc5c(Cl)cc(Cl)cc54)c3)c2)C1
SMILES: CN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(S(=O)(=O)NCCOCCOCCOCCNC(=O)NCCCCNC(=O)NCCOCCOCCOCCNS(=O)(=O)c3cccc(C4CN(C)Cc5c(Cl)cc(Cl)cc54)c3)c2)C1

Molecular Processing

Molecular formula
C54H74Cl4N8O12S2
Molecular weight
1233.18
Exact mass
1230.3622
XLogP
6.19
TPSA
236.46
H-bond donors
6
H-bond acceptors
14
Rotatable bonds
35
Heavy atoms
80
Rings
6
Aromatic rings
4
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
26
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
309.49

Supplementary Information

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Involved in 4 reactions→

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