이름: 2-butyl-5-cyano-4-propionyl-1-tritylimidazole
SMILES:
CCCCc1nc(C(=O)CC)c(C#N)n1C(c1ccccc1)(c1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C30H29N3O
Molecular weight
447.58
Exact mass
447.2311
XLogP
6.53
TPSA
58.68
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
34
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
134.78
Supplementary Information
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