Name: 4-(4-tert-Butoxycarbonyl-1-piperazinyl)methyl-2-cyclopropylmethyl-6-(3-fluoro-4-methoxyphenyl)-2H-pyridazine-3-one
SMILES:
COc1ccc(-c2cc(CN3CCN(C(=O)OC(C)(C)C)CC3)c(=O)n(CC3CC3)n2)cc1FMolecular Processing
Molecular formula
C25H33FN4O4
Molecular weight
472.56
Exact mass
472.2486
XLogP
3.52
TPSA
76.9
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.56
Molar refractivity
126.25
Supplementary Information
Details werden geladen…
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