Name: 1-[3-(4-chloro-phenyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
SMILES:
CC(=O)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2C1Molecular Processing
Molecular formula
C14H14ClN3O
Molecular weight
275.74
Exact mass
275.0825
XLogP
2.63
TPSA
48.99
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
73.83
Supplementary Information
Details werden geladen…
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