CCOC(=O)C1CCCCN1C(=O)c1cc2ncnc(NC(C)c3nc4cc(Cl)ccc4[nH]3)c2cc1Cl
SMILES: CCOC(=O)C1CCCCN1C(=O)c1cc2ncnc(NC(C)c3nc4cc(Cl)ccc4[nH]3)c2cc1Cl

Molecular Processing

Molecular formula
C26H26Cl2N6O3
Molecular weight
541.44
Exact mass
540.1443
XLogP
5.54
TPSA
113.1
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.346
Molar refractivity
143

Supplementary Information

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Involved in 3 reactions→

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