Nombre: 1-(2-acetamidoethyl)-5-(2,4-dinitrophenylthio)tetrazole
SMILES:
CC(=O)NCCn1nnnc1Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C11H11N7O5S
Molecular weight
353.32
Exact mass
353.0542
XLogP
0.78
TPSA
158.98
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
80.37
Supplementary Information
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