3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide

C20H15FN2O2S — CID 91210071

IUPAC3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc2cc[nH]c2c1)c1cccc(-c2ccc(F)cc2)c1
InChIInChI=1S/C20H15FN2O2S/c21-17-7-4-14(5-8-17)16-2-1-3-19(12-16)26(24,25)23-18-9-6-15-10-11-22-20(15)13-18/h1-13,22-23H
InChIKeyMBFZRHFSVTYEBH-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.77
Rot. Bonds4

About 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide

3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide (PubChem CID 91210071) has the molecular formula C20H15FN2O2S and a molecular weight of 366.42 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide
PubChem CID91210071
Molecular FormulaC20H15FN2O2S
Molecular Weight366.42 g/mol
Exact Mass366.08
IUPAC Name3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc2cc[nH]c2c1)c1cccc(-c2ccc(F)cc2)c1
InChIInChI=1S/C20H15FN2O2S/c21-17-7-4-14(5-8-17)16-2-1-3-19(12-16)26(24,25)23-18-9-6-15-10-11-22-20(15)13-18/h1-13,22-23H
InChIKeyMBFZRHFSVTYEBH-UHFFFAOYSA-N
XLogP4.77
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethylphenyl)-3-(4-fluorophenyl)benzenesulfonamide
CID 71211560
2-fluoro-N-(1H-indol-6-yl)benzenesulfonamide
CID 71954733
N-(1H-indol-6-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110730882
N-(1H-indol-5-yl)naphthalene-2-sulfonamide
CID 3718023
N,3-diphenylbenzenesulfonamide
CID 54513984
3-chloro-N-(1H-indol-6-yl)-4-methoxybenzenesulfonamide
CID 110730867
N-pyridin-4-yl-1H-indole-6-sulfonamide
CID 118077965
3-cyano-N-(1H-indol-5-yl)benzenesulfonamide
CID 5239673
N-(1H-indol-6-yl)ethanesulfonamide
CID 110730845
N-(1H-indol-6-yl)-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide
CID 110730877
2-[[3-(4-fluorophenyl)phenyl]sulfonylamino]benzoic acid
CID 123387963
[3-(4-fluorophenyl)phenyl]sulfonylazanide
CID 143427980

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide (CID 91210071) is 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide is O=S(=O)(Nc1ccc2cc[nH]c2c1)c1cccc(-c2ccc(F)cc2)c1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide?
The InChIKey is MBFZRHFSVTYEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O2S/c21-17-7-4-14(5-8-17)16-2-1-3-19(12-16)26(24,25)23-18-9-6-15-10-11-22-20(15)13-18/h1-13,22-23H.
What are the key properties of 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide?
3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide has a molecular weight of 366.42 g/mol, XLogP of 4.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(1H-indol-6-yl)benzenesulfonamide is sourced from PubChem (CID 91210071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).