SMILES:
CCCCn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(N)nc21Molecular Processing
Molecular formula
C17H16Cl2N4O
Molecular weight
363.25
Exact mass
362.0701
XLogP
4.15
TPSA
73.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
98.57
Supplementary Information
Récupération des détails…
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