الاسم: 1′-benzyl-6-(4-phenoxyphenyl)-1,2-dihydrospiro[imidazo[1,2-b]pyrazole-3,4′-piperidine]-7-carbonitrile
SMILES:
N#Cc1c(-c2ccc(Oc3ccccc3)cc2)nn2c1NCC21CCN(Cc2ccccc2)CC1Molecular Processing
Molecular formula
C29H27N5O
Molecular weight
461.57
Exact mass
461.2216
XLogP
5.63
TPSA
66.11
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
35
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
136.31
Supplementary Information
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