SMILES:
O=C(CCCCCl)Nc1cccc(-c2n[nH]c(=O)c3c2CCCC3)c1Molecular Processing
Molecular formula
C19H22ClN3O2
Molecular weight
359.86
Exact mass
359.1401
XLogP
3.66
TPSA
74.85
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
100.14
Supplementary Information
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