Name: tert-butyl 4-(6-bromobenzo[d]thiazol-2-yloxy)piperidine-1-carboxylate
SMILES:
CC(C)(C)OC(=O)N1CCC(Oc2nc3ccc(Br)cc3s2)CC1Molecular Processing
Molecular formula
C17H21BrN2O3S
Molecular weight
413.34
Exact mass
412.0456
XLogP
4.84
TPSA
51.66
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
98.78
Supplementary Information
Details werden geladen…
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