الاسم: 5-[4′-(bromomethyl)biphenyl-2-yl]-1-(p-methoxybenzyl)-1H-tetrazole
SMILES:
COc1ccc(Cn2nnnc2-c2ccccc2-c2ccc(CBr)cc2)cc1Molecular Processing
Molecular formula
C22H19BrN4O
Molecular weight
435.33
Exact mass
434.0742
XLogP
4.96
TPSA
52.83
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
113.42
Supplementary Information
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