Name: 3-ethoxycarbonylmethyl-5-fluoro-1H-indole-2-carboxylic acid ethyl ester
SMILES:
CCOC(=O)Cc1c(C(=O)OCC)[nH]c2ccc(F)cc12Molecular Processing
Molecular formula
C15H16FNO4
Molecular weight
293.29
Exact mass
293.1063
XLogP
2.59
TPSA
68.39
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
74.55
Supplementary Information
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