SMILES:
CCC(CC)N1C(=O)C(C)(CC(=O)NNC(N)=O)CC(c2cccc(Cl)c2)C1c1ccc(Cl)cc1Molecular Processing
Molecular formula
C26H32Cl2N4O3
Molecular weight
519.47
Exact mass
518.1851
XLogP
5.34
TPSA
104.53
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
137.8
Supplementary Information
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