2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide

C15H12Cl2N2O2S — CID 59823134

IUPAC2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide
SMILESCn1ccc2cc(NS(=O)(=O)c3ccc(Cl)cc3Cl)ccc21
InChIInChI=1S/C15H12Cl2N2O2S/c1-19-7-6-10-8-12(3-4-14(10)19)18-22(20,21)15-5-2-11(16)9-13(15)17/h2-9,18H,1H3
InChIKeyHTSUTTIWVITTQZ-UHFFFAOYSA-N
MW355.25 g/mol
LogP4.29
Rot. Bonds3

About 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide

2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide (PubChem CID 59823134) has the molecular formula C15H12Cl2N2O2S and a molecular weight of 355.25 g/mol. Its IUPAC name is 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide
PubChem CID59823134
Molecular FormulaC15H12Cl2N2O2S
Molecular Weight355.25 g/mol
Exact Mass354.00
IUPAC Name2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide
SMILESCn1ccc2cc(NS(=O)(=O)c3ccc(Cl)cc3Cl)ccc21
InChIInChI=1S/C15H12Cl2N2O2S/c1-19-7-6-10-8-12(3-4-14(10)19)18-22(20,21)15-5-2-11(16)9-13(15)17/h2-9,18H,1H3
InChIKeyHTSUTTIWVITTQZ-UHFFFAOYSA-N
XLogP4.29
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.25
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dichloro-N-(1-methylindazol-5-yl)benzenesulfonamide
CID 59514150
2,4-dichloro-N-(4-propan-2-ylphenyl)benzenesulfonamide
CID 69228032
N-(1-methylindol-5-yl)thiophene-2-sulfonamide
CID 110867814
2,5-dichloro-N-[(2S)-2-hydroxy-2-(1-methylindol-5-yl)ethyl]benzenesulfonamide
CID 124760956
2,4-dichloro-N-(2-methyl-1,3-benzoxazol-5-yl)benzenesulfonamide
CID 69227449
2,4-dichloro-N-[1-(2-methylpropyl)-3-oxo-2H-indazol-5-yl]benzenesulfonamide
CID 11517216
2,4-dichloro-N-[4-(diethylamino)phenyl]benzenesulfonamide
CID 3830236
N-(1,3-benzodioxol-5-yl)-2,4-dichlorobenzenesulfonamide
CID 3716276
N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine
CID 82536377
2,4-dichloro-N-[2-[(2,4-dichlorophenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 70137943
4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide
CID 4849983
2,4-dichloro-N-(1,5,6-trimethylbenzimidazol-4-yl)benzenesulfonamide
CID 1474204

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide?
The IUPAC name of 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide (CID 59823134) is 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide.
What is the SMILES notation for 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide?
The canonical SMILES for 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide is Cn1ccc2cc(NS(=O)(=O)c3ccc(Cl)cc3Cl)ccc21.
What is the InChIKey of 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide?
The InChIKey is HTSUTTIWVITTQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2S/c1-19-7-6-10-8-12(3-4-14(10)19)18-22(20,21)15-5-2-11(16)9-13(15)17/h2-9,18H,1H3.
What are the key properties of 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide?
2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide has a molecular weight of 355.25 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide is sourced from PubChem (CID 59823134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).