Name: title compound
SMILES:
CN(C)Cc1cccc(-c2[nH]c3cc(NC(=O)[C@@H]4C[C@H]4c4ccccc4)cc4c3c2C=NNC4=O)c1Molecular Processing
Molecular formula
C29H27N5O2
Molecular weight
477.57
Exact mass
477.2165
XLogP
4.72
TPSA
89.59
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
36
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.207
Molar refractivity
142.11
Supplementary Information
Details werden geladen…
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