Name: 2-chloro-1,3-benzothiazole-5-carbonitrile
SMILES:
N#Cc1ccc2sc(Cl)nc2c1Molecular Processing
Molecular formula
C8H3ClN2S
Molecular weight
194.65
Exact mass
193.9705
XLogP
2.82
TPSA
36.68
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
49.35
Supplementary Information
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Involved in 3 reactions→