SMILES:
Cc1nn(-c2ccc(CCNC(=O)Oc3ccccc3)cc2)c(C)c1-c1ccccc1Molecular Processing
Molecular formula
C26H25N3O2
Molecular weight
411.51
Exact mass
411.1947
XLogP
5.49
TPSA
56.15
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
122.65
Supplementary Information
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