Name: 3-fluoro-1,3-dihydro-7-nitro-5-phenyl-2H-1,4-benzodiazepin-2-one
SMILES:
O=C1Nc2ccc([N+](=O)[O-])cc2C(c2ccccc2)=NC1FMolecular Processing
Molecular formula
C15H10FN3O3
Molecular weight
299.26
Exact mass
299.0706
XLogP
2.68
TPSA
84.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
78.7
Supplementary Information
Details werden geladen…
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