Name: Methyl (±)-[5-(aminophenylmethyl)-1H-benzimidazol-2-yl]carbamate
SMILES:
COC(=O)Nc1nc2cc(C(N)c3ccccc3)ccc2[nH]1Molecular Processing
Molecular formula
C16H16N4O2
Molecular weight
296.33
Exact mass
296.1273
XLogP
2.79
TPSA
93.03
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
84.59
Supplementary Information
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