Cc1n[nH]c2c1nc(-c1ccccc1)c1ccccc12
Name: 5-phenyl-3-methyl-1H-pyrazolo[4,3-c]isoquinoline
SMILES: Cc1n[nH]c2c1nc(-c1ccccc1)c1ccccc12

Molecular Processing

Molecular formula
C17H13N3
Molecular weight
259.31
Exact mass
259.1109
XLogP
4.09
TPSA
41.57
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
81.57

Supplementary Information

Details werden geladen…

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