SMILES:
CCNCC.Cn1c(C#N)ccc1-c1ccc2c(c1)C1(CCCCC1)C(=NC#N)N2Molecular Processing
Molecular formula
C24H30N6
Molecular weight
402.55
Exact mass
402.2532
XLogP
4.69
TPSA
88.93
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.458
Molar refractivity
121.22
Supplementary Information
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