CC(C)(C)OC(=O)N1CCC2(CC1)CNc1ccc(Br)cc12
SMILES: CC(C)(C)OC(=O)N1CCC2(CC1)CNc1ccc(Br)cc12

Molecular Processing

Molecular formula
C17H23BrN2O2
Molecular weight
367.29
Exact mass
366.0943
XLogP
4.14
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
91.35

Supplementary Information

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