Name: 3,5-bis-(1,1-dimethylethyl)-4-hydroxy-N-(4-nitrophenyl)-benzamide
SMILES:
CC(C)(C)c1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc(C(C)(C)C)c1OMolecular Processing
Molecular formula
C21H26N2O4
Molecular weight
370.45
Exact mass
370.1893
XLogP
5.15
TPSA
92.47
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
106.56
Supplementary Information
Details werden geladen…
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