الاسم: 1-(4-diethylaminophenyl)-2-ethoxycarbonylmethyl-5-(4-trifluoromethylphenoxy)indole-3-carboxylic acid ethyl ester
SMILES:
CCOC(=O)Cc1c(C(=O)OCC)c2cc(Oc3ccc(C(F)(F)F)cc3)ccc2n1-c1ccc(N(CC)CC)cc1Molecular Processing
Molecular formula
C32H33F3N2O5
Molecular weight
582.62
Exact mass
582.2342
XLogP
7.57
TPSA
70
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
42
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
154.65
Supplementary Information
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