Name: title compound
SMILES:
CC(=O)Nc1ccc2c(c1)C(=Cc1[nH]c3c(c1C)C(=O)N(CCN1CCOCC1)CC3)C(=O)N2Molecular Processing
Molecular formula
C25H29N5O4
Molecular weight
463.54
Exact mass
463.222
XLogP
2.1
TPSA
106.77
H-bond donors
3
H-bond acceptors
5
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
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
129.64
Supplementary Information
Details werden geladen…
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