C=C(C)OC(=O)OC1C(C)=CC2C(C(C)C)CCC(C)C2(O)C1OC(=O)C1CC2(O)c3cccc(Cl)c3N(C)OC2N1
SMILES: C=C(C)OC(=O)OC1C(C)=CC2C(C(C)C)CCC(C)C2(O)C1OC(=O)C1CC2(O)c3cccc(Cl)c3N(C)OC2N1

Molecular Processing

Molecular formula
C31H41ClN2O8
Molecular weight
605.13
Exact mass
604.2551
XLogP
4.57
TPSA
126.79
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
5
Heavy atoms
42
Rings
5
Aromatic rings
1
Saturated rings
2
Aliphatic rings
4
Stereo centers
9
Undefined stereo
9
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.613
Molar refractivity
155.14

Supplementary Information

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