CCN(CC)CCOc1ccc(Nc2ncc3c(n2)N(c2ccccc2)C(=O)N(c2c(Cl)cccc2Cl)C3)cc1
SMILES: CCN(CC)CCOc1ccc(Nc2ncc3c(n2)N(c2ccccc2)C(=O)N(c2c(Cl)cccc2Cl)C3)cc1

Molecular Processing

Molecular formula
C30H30Cl2N6O2
Molecular weight
577.52
Exact mass
576.1807
XLogP
7.53
TPSA
73.83
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
40
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
161.66

Supplementary Information

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