CC1(c2cc(Br)ccc2F)COCC(=S)N1
Name: 5-(5-bromo-2-fluoro-phenyl)-5-methyl-morpholine-3-thione
SMILES: CC1(c2cc(Br)ccc2F)COCC(=S)N1

Molecular Processing

Molecular formula
C11H11BrFNOS
Molecular weight
304.18
Exact mass
302.9729
XLogP
2.75
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
68

Supplementary Information

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