O=C(c1c(Cl)cc(Cl)cc1Cl)N(Cc1cccc(OC2CCCCO2)c1)c1ccc(OCCN2CCCC2)cc1
SMILES: O=C(c1c(Cl)cc(Cl)cc1Cl)N(Cc1cccc(OC2CCCCO2)c1)c1ccc(OCCN2CCCC2)cc1

Molecular Processing

Molecular formula
C31H33Cl3N2O4
Molecular weight
603.97
Exact mass
602.1506
XLogP
7.87
TPSA
51.24
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
40
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.387
Molar refractivity
160.26

Supplementary Information

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