Name: 2-[(E)-4-Imidazol-1-yl-phenylimino]-propionic acid ethyl ester
SMILES:
CCOC(=O)/C(C)=N/c1ccc(-n2ccnc2)cc1Molecular Processing
Molecular formula
C14H15N3O2
Molecular weight
257.29
Exact mass
257.1164
XLogP
2.53
TPSA
56.48
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
72.97
Supplementary Information
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Involved in 4 reactions→