CCOC(=O)n1c(C(=O)c2ccc(OC)cc2)c(NC(C)=O)c2ccc(Cl)cc21
SMILES: CCOC(=O)n1c(C(=O)c2ccc(OC)cc2)c(NC(C)=O)c2ccc(Cl)cc21

Molecular Processing

Molecular formula
C21H19ClN2O5
Molecular weight
414.85
Exact mass
414.0982
XLogP
4.5
TPSA
86.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
110.1

Supplementary Information

Details werden geladen…

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