3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide

C15H12Cl2N2O2S — CID 59276867

IUPAC3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide
SMILESCc1cc2[nH]ccc2cc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H12Cl2N2O2S/c1-9-4-15-10(2-3-18-15)5-14(9)19-22(20,21)13-7-11(16)6-12(17)8-13/h2-8,18-19H,1H3
InChIKeyMLPFCILSYCPFSI-UHFFFAOYSA-N
MW355.25 g/mol
LogP4.58
Rot. Bonds3

About 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide

3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide (PubChem CID 59276867) has the molecular formula C15H12Cl2N2O2S and a molecular weight of 355.25 g/mol. Its IUPAC name is 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide
PubChem CID59276867
Molecular FormulaC15H12Cl2N2O2S
Molecular Weight355.25 g/mol
Exact Mass354.00
IUPAC Name3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide
SMILESCc1cc2[nH]ccc2cc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H12Cl2N2O2S/c1-9-4-15-10(2-3-18-15)5-14(9)19-22(20,21)13-7-11(16)6-12(17)8-13/h2-8,18-19H,1H3
InChIKeyMLPFCILSYCPFSI-UHFFFAOYSA-N
XLogP4.58
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.25
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide (CID 59276867) is 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide is Cc1cc2[nH]ccc2cc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide?
The InChIKey is MLPFCILSYCPFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2S/c1-9-4-15-10(2-3-18-15)5-14(9)19-22(20,21)13-7-11(16)6-12(17)8-13/h2-8,18-19H,1H3.
What are the key properties of 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide?
3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide has a molecular weight of 355.25 g/mol, XLogP of 4.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(6-methyl-1H-indol-5-yl)benzenesulfonamide is sourced from PubChem (CID 59276867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).