CCN(CC)CCN1CCc2[nH]c(C=C3C(=O)Nc4ccc(OC)cc43)c(C)c2C1=O
Name: title compound
SMILES: CCN(CC)CCN1CCc2[nH]c(C=C3C(=O)Nc4ccc(OC)cc43)c(C)c2C1=O

Molecular Processing

Molecular formula
C24H30N4O3
Molecular weight
422.53
Exact mass
422.2318
XLogP
3.16
TPSA
77.67
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
122.42

Supplementary Information

Details werden geladen…

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