Name: 5-[4-(2-hydroxyethyl)-1-piperazinyl]-N-methyl-2-nitrobenzamide
SMILES:
CNC(=O)c1cc(N2CCN(CCO)CC2)ccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C14H20N4O4
Molecular weight
308.34
Exact mass
308.1485
XLogP
0.07
TPSA
98.95
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
82.23
Supplementary Information
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Involved in 4 reactions→