Name: methyl 2-chloro-5-(4-morpholinyl)-1H-benzimidazole-7-carboxylate
SMILES:
COC(=O)c1cc(N2CCOCC2)cc2nc(Cl)[nH]c12Molecular Processing
Molecular formula
C13H14ClN3O3
Molecular weight
295.73
Exact mass
295.0724
XLogP
1.84
TPSA
67.45
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
20
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
0.385
Molar refractivity
75.48
Supplementary Information
Details werden geladen…
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