Name: diethyl 1-benzyl-2-bromomethylimidazole-4,5-dicarboxylate
SMILES:
CCOC(=O)C1=C(C(=O)OCC)N(Cc2ccccc2)C(C)(Br)N1Molecular Processing
Molecular formula
C17H21BrN2O4
Molecular weight
397.27
Exact mass
396.0685
XLogP
2.5
TPSA
67.87
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
92.74
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→