이름: {9-[(phenyl)methyl]-2-(4-trifluoromethylphenyl)-5-carbamoylcarbazol-4-yl}oxyacetic acid, methyl ester
SMILES:
COC(=O)COc1cc(-c2ccc(C(F)(F)F)cc2)cc2c1c1c(C(N)=O)cccc1n2Cc1ccccc1Molecular Processing
Molecular formula
C30H23F3N2O4
Molecular weight
532.52
Exact mass
532.161
XLogP
6.18
TPSA
83.55
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
39
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
141.45
Supplementary Information
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