الاسم: 1-ethoxycarbonyl-4-((benzothiazol-2-yl)methyl)piperidine
SMILES:
CCOC(=O)N1CCC(Cc2nc3ccccc3s2)CC1Molecular Processing
Molecular formula
C16H20N2O2S
Molecular weight
304.42
Exact mass
304.1245
XLogP
3.71
TPSA
42.43
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
84.64
Supplementary Information
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