CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)C(C(=O)O)C1
SMILES: CCCCCN(CCCCC)C(=O)N1CCN(C(=O)N(c2ccccc2)c2cccc(Cl)c2)C(C(=O)O)C1

Molecular Processing

Molecular formula
C29H39ClN4O4
Molecular weight
543.11
Exact mass
542.266
XLogP
6.47
TPSA
84.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
11
Heavy atoms
38
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.483
Molar refractivity
151.15

Supplementary Information

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