Cn1cccc1C(=O)C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1
SMILES: Cn1cccc1C(=O)C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1

Molecular Processing

Molecular formula
C15H12N4O4
Molecular weight
312.29
Exact mass
312.0859
XLogP
1.89
TPSA
118.03
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
80.57

Supplementary Information

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