CCOC(=O)C1=C(COCc2nnn(CCN3CCN(C(=O)NC)CC3)n2)NC(C)=C(C(=O)OC)C1c1cccc(Cl)c1Cl
SMILES: CCOC(=O)C1=C(COCc2nnn(CCN3CCN(C(=O)NC)CC3)n2)NC(C)=C(C(=O)OC)C1c1cccc(Cl)c1Cl

Molecular Processing

Molecular formula
C28H36Cl2N8O6
Molecular weight
651.55
Exact mass
650.2135
XLogP
2.1
TPSA
153.04
H-bond donors
2
H-bond acceptors
11
Rotatable bonds
11
Heavy atoms
44
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
160.66

Supplementary Information

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