الاسم: (S)-2-[4-(2,4-difluoro-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-methyl-pentanoic acid methyl ester
SMILES:
COC(=O)[C@H](CC(C)C)N1CC(Oc2ccc(F)cc2F)=CC1=OMolecular Processing
Molecular formula
C17H19F2NO4
Molecular weight
339.34
Exact mass
339.1282
XLogP
2.66
TPSA
55.84
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
82.04
Supplementary Information
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