名称: tert-butyl {1-[4-(6-chloro-7,8-dimethyl-3-phenylimidazo[1,2-b]pyridazin-2-yl)phenyl]cyclobutyl}carbamate
SMILES:
Cc1c(Cl)nn2c(-c3ccccc3)c(-c3ccc(C4(NC(=O)OC(C)(C)C)CCC4)cc3)nc2c1CMolecular Processing
Molecular formula
C29H31ClN4O2
Molecular weight
503.05
Exact mass
502.2136
XLogP
7.24
TPSA
68.52
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
36
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.345
Molar refractivity
143.24
Supplementary Information
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