Nombre: 4′-Methyl-5-tetrazol-1-yl-biphenyl-3-carboxylic acid methyl ester
SMILES:
COC(=O)c1cc(-c2ccc(C)cc2)cc(-n2cnnn2)c1Molecular Processing
Molecular formula
C16H14N4O2
Molecular weight
294.31
Exact mass
294.1117
XLogP
2.42
TPSA
69.9
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
80.67
Supplementary Information
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