Nom: N1,N1′,N1″-([1,1′-biphenyl]-3,3′,5-triyltris(methylene))tris(N3-(3-(isobutylamino)propyl)propane-1,3-diamine)
SMILES:
CC(C)CNCCCNCCCNCC1=CC(CNCCCNCCCNCC(C)C)(CNCCCNCCCNCC(C)C)CC(c2ccccc2)=C1Molecular Processing
Molecular formula
C45H87N9
Molecular weight
754.25
Exact mass
753.7084
XLogP
5
TPSA
108.27
H-bond donors
9
H-bond acceptors
9
Rotatable bonds
37
Heavy atoms
54
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
237.6
Supplementary Information
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