الاسم: 3-[(2′-oxo-2,3-dihydrospiro[furo[2,3-g][1,4]benzodioxine-8,3′-indol]-1′(2′H)-yl)methyl]benzonitrile
SMILES:
N#Cc1cccc(CN2C(=O)C3(COc4cc5c(cc43)OCCO5)c3ccccc32)c1Molecular Processing
Molecular formula
C25H18N2O4
Molecular weight
410.43
Exact mass
410.1267
XLogP
3.55
TPSA
71.79
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
31
Rings
6
Aromatic rings
3
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
112.5
Supplementary Information
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