이름: 1-[3-(4-Chloro-phenyl)-1-(3-chloro-propyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone
SMILES:
CC(=O)N1CCc2c(c(-c3ccc(Cl)cc3)nn2CCCCl)C1Molecular Processing
Molecular formula
C17H19Cl2N3O
Molecular weight
352.27
Exact mass
351.0905
XLogP
3.74
TPSA
38.13
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
92.81
Supplementary Information
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