الاسم: title compound
SMILES:
COc1cc(OC)c(Cl)c(-c2ccc(C(=O)Nc3ccc(CN4CCN(C)CC4)cn3)c3nc(C)c(C)nc23)c1ClMolecular Processing
Molecular formula
C30H32Cl2N6O3
Molecular weight
595.53
Exact mass
594.1913
XLogP
5.63
TPSA
92.71
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
41
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
162.54
Supplementary Information
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