Name: title compound
SMILES:
CC(=O)Nc1ccc2c(c1)C(=Cc1[nH]c3c(c1C)C(=O)N(CCN1CCCCC1)CC3)C(=O)N2Molecular Processing
Molecular formula
C26H31N5O3
Molecular weight
461.57
Exact mass
461.2427
XLogP
3.26
TPSA
97.54
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
34
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
132.67
Supplementary Information
Details werden geladen…
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