الاسم: 1′-benzyl-2-oxo-6-(4-phenoxyphenyl)-1,2-dihydrospiro[imidazo[1,2-b]pyrazole-3,4′-piperidine]-7-carboxamide
SMILES:
NC(=O)c1c(-c2ccc(Oc3ccccc3)cc2)nn2c1NC(=O)C21CCN(Cc2ccccc2)CC1Molecular Processing
Molecular formula
C29H27N5O3
Molecular weight
493.57
Exact mass
493.2114
XLogP
4.38
TPSA
102.48
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
37
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.207
Molar refractivity
140.25
Supplementary Information
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