Name: 6-fluoro-5-(4-methylpiperazin-1-yl)-2-mercapto-1H-benzimidazole
SMILES:
CN1CCN(c2cc3nc(S)[nH]c3cc2F)CC1Molecular Processing
Molecular formula
C12H15FN4S
Molecular weight
266.35
Exact mass
266.1001
XLogP
1.74
TPSA
35.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
73.01
Supplementary Information
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Involved in 5 reactions→