CN(C(=O)OC(C)(C)C)[C@H](Cc1ccc(O)cc1)C(=O)Nc1cc2c3c(c(-c4ccccc4)[nH]c3c1)C=NNC2=O
Name: title compound
SMILES: CN(C(=O)OC(C)(C)C)[C@H](Cc1ccc(O)cc1)C(=O)Nc1cc2c3c(c(-c4ccccc4)[nH]c3c1)C=NNC2=O

Molecular Processing

Molecular formula
C31H31N5O5
Molecular weight
553.62
Exact mass
553.2325
XLogP
5.03
TPSA
136.12
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
41
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.226
Molar refractivity
157.02

Supplementary Information

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