名称: 1-[4-(4,5-dichloro-2-methylimidazol-1-yl)butyl]piperidin-4-one
SMILES:
CC1=NC(=C(N1CCCCN2CCC(=O)CC2)Cl)ClMolecular Processing
Molecular formula
C13H19Cl2N3O
Molecular weight
304.22
Exact mass
303.0905
XLogP
2.94
TPSA
38.13
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
76.9
Supplementary Information
InChIKey: BBBDYIPPPKVHBX-UHFFFAOYSA-N
同義語
4,5-dichloro-2-methyl-1-(4-(4-oxo-1-piperidyl)butyl]-1H-imidazole4,5-dichloro-2-methyl-1-[4-(4-oxo-1-piperidyl)butyl]-1H-imidazoleSCHEMBL7959296BBBDYIPPPKVHBX-UHFFFAOYSA-N
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