Name: tert-butyl 2-amino-4-(hept-6-ynyl)-1H-imidazole-1-carboxylate
SMILES:
C#CCCCCCc1cn(C(=O)OC(C)(C)C)c(N)n1Molecular Processing
Molecular formula
C15H23N3O2
Molecular weight
277.37
Exact mass
277.179
XLogP
2.98
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
79.28
Supplementary Information
Details werden geladen…
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