Name: [5-phenyl-1-(4-pyridyl)tetrahydro-1H-2-imidazolyliden] aminomethane-nitrile
SMILES:
N#CN=C1NCC(c2ccccc2)N1c1ccncc1Molecular Processing
Molecular formula
C15H13N5
Molecular weight
263.3
Exact mass
263.1171
XLogP
2.07
TPSA
64.31
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
76.95
Supplementary Information
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Involved in 3 reactions→