Name: 117a
SMILES:
CC(C)(C)OC(=O)N1CC(c2ccc(Cl)nc2)C1Molecular Processing
Molecular formula
C13H17ClN2O2
Molecular weight
268.74
Exact mass
268.0979
XLogP
3.07
TPSA
42.43
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
69.8
Supplementary Information
Details werden geladen…
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