CCOC(=O)C1=C(COCCNC(=O)COc2ccc(C3=NNC(=O)CC3)cc2Cl)NC(C)=C(C(=O)OC)C1c1ccccc1Cl
SMILES: CCOC(=O)C1=C(COCCNC(=O)COc2ccc(C3=NNC(=O)CC3)cc2Cl)NC(C)=C(C(=O)OC)C1c1ccccc1Cl

Molecular Processing

Molecular formula
C32H34Cl2N4O8
Molecular weight
673.55
Exact mass
672.1754
XLogP
3.77
TPSA
153.65
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
13
Heavy atoms
46
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.344
Molar refractivity
170.39

Supplementary Information

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