CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCOC(=O)CC2)c2ncnn12
SMILES: CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCOC(=O)CC2)c2ncnn12

Molecular Processing

Molecular formula
C29H28N6O5
Molecular weight
540.58
Exact mass
540.2121
XLogP
3.71
TPSA
137.38
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
40
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
145.89

Supplementary Information

Details werden geladen…

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