1-(4-chlorophenyl)sulfonylindole

C14H10ClNO2S — CID 4689237

IUPAC1-(4-chlorophenyl)sulfonylindole
SMILESO=S(=O)(c1ccc(Cl)cc1)n1ccc2ccccc21
InChIInChI=1S/C14H10ClNO2S/c15-12-5-7-13(8-6-12)19(17,18)16-10-9-11-3-1-2-4-14(11)16/h1-10H
InChIKeyGRAQCFPVLLNGMX-UHFFFAOYSA-N
MW291.76 g/mol
LogP3.53
Rot. Bonds2

About 1-(4-chlorophenyl)sulfonylindole

1-(4-chlorophenyl)sulfonylindole (PubChem CID 4689237) has the molecular formula C14H10ClNO2S and a molecular weight of 291.76 g/mol. Its IUPAC name is 1-(4-chlorophenyl)sulfonylindole.

Molecular Properties

Compound Name1-(4-chlorophenyl)sulfonylindole
PubChem CID4689237
Molecular FormulaC14H10ClNO2S
Molecular Weight291.76 g/mol
Exact Mass291.01
IUPAC Name1-(4-chlorophenyl)sulfonylindole
SMILESO=S(=O)(c1ccc(Cl)cc1)n1ccc2ccccc21
InChIInChI=1S/C14H10ClNO2S/c15-12-5-7-13(8-6-12)19(17,18)16-10-9-11-3-1-2-4-14(11)16/h1-10H
InChIKeyGRAQCFPVLLNGMX-UHFFFAOYSA-N
XLogP3.53
TPSA39.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.76
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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ethane;1-(3-methoxyphenyl)sulfonylindole
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1-(benzenesulfonyl)-4-chloroindole
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1-(benzenesulfonyl)-5-chloropyrrolo[3,2-b]pyridine
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1-(benzenesulfonyl)indole-6-carbaldehyde
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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)sulfonylindole?
The IUPAC name of 1-(4-chlorophenyl)sulfonylindole (CID 4689237) is 1-(4-chlorophenyl)sulfonylindole.
What is the SMILES notation for 1-(4-chlorophenyl)sulfonylindole?
The canonical SMILES for 1-(4-chlorophenyl)sulfonylindole is O=S(=O)(c1ccc(Cl)cc1)n1ccc2ccccc21.
What is the InChIKey of 1-(4-chlorophenyl)sulfonylindole?
The InChIKey is GRAQCFPVLLNGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClNO2S/c15-12-5-7-13(8-6-12)19(17,18)16-10-9-11-3-1-2-4-14(11)16/h1-10H.
What are the key properties of 1-(4-chlorophenyl)sulfonylindole?
1-(4-chlorophenyl)sulfonylindole has a molecular weight of 291.76 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)sulfonylindole is sourced from PubChem (CID 4689237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).