Name: 1-[7-chloro-2-(3-methylphenyl)pyrazolo[1,5-a]pyridin-3-yl]-2-propyn-1-one
SMILES:
C#CC(=O)c1c(-c2cccc(C)c2)nn2c(Cl)cccc12Molecular Processing
Molecular formula
C17H11ClN2O
Molecular weight
294.74
Exact mass
294.056
XLogP
3.78
TPSA
34.37
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
83.54
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→