CCOc1ccc(F)c(OC2=CC(=O)N([C@@H](CC(C)C)C(=O)OC)C2)c1F
Name: (S)-2-[4-(3-ethoxy-2,6-difluoro-phenoxy)-2-oxo-2,5-dihydro-pyrrol-1-yl]-4-methyl-pentanoic acid methyl ester
SMILES: CCOc1ccc(F)c(OC2=CC(=O)N([C@@H](CC(C)C)C(=O)OC)C2)c1F

Molecular Processing

Molecular formula
C19H23F2NO5
Molecular weight
383.39
Exact mass
383.1544
XLogP
3.06
TPSA
65.07
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
27
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
93.21

Supplementary Information

Details werden geladen…

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