SMILES:
CNC(=O)Nc1ccc(C2=NN(C(C)=O)C(C)Cc3cc4c(cc32)OCO4)cc1Molecular Processing
Molecular formula
C21H22N4O4
Molecular weight
394.43
Exact mass
394.1641
XLogP
2.71
TPSA
92.26
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
108.41
Supplementary Information
Récupération des détails…
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