C1=CC(=CC=C1C2=C(C(=C(N2)Br)Br)S(=O)(=O)C(F)(F)F)Cl
Название: 2,3-dibromo-5-(4-chlorophenyl)-4-(trifluoromethylsulfonyl)-1H-pyrrole
SMILES: C1=CC(=CC=C1C2=C(C(=C(N2)Br)Br)S(=O)(=O)C(F)(F)F)Cl

Molecular Processing

Molecular formula
C11H5Br2ClF3NO2S
Molecular weight
467.49
Exact mass
464.8048
XLogP
5.15
TPSA
49.93
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
79.88

Supplementary Information

InChIKey: VDNVTCBCYSVMEU-UHFFFAOYSA-N
Синонимы
2,3-dibromo-5-(p-chlorophenyl)-4-[(trifluoromethyl)sulfonyl]pyrroleSCHEMBL1180312
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