4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide

C15H12ClN3O3S — CID 10665503

IUPAC4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)Nc2cccc3c(Cl)c[nH]c23)cc1
InChIInChI=1S/C15H12ClN3O3S/c16-12-8-18-14-11(12)2-1-3-13(14)19-23(21,22)10-6-4-9(5-7-10)15(17)20/h1-8,18-19H,(H2,17,20)
InChIKeyUQEUNMCUNMWMBX-UHFFFAOYSA-N
MW349.80 g/mol
LogP2.72
Rot. Bonds4

About 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide

4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide (PubChem CID 10665503) has the molecular formula C15H12ClN3O3S and a molecular weight of 349.80 g/mol. Its IUPAC name is 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide
PubChem CID10665503
Molecular FormulaC15H12ClN3O3S
Molecular Weight349.80 g/mol
Exact Mass349.03
IUPAC Name4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)Nc2cccc3c(Cl)c[nH]c23)cc1
InChIInChI=1S/C15H12ClN3O3S/c16-12-8-18-14-11(12)2-1-3-13(14)19-23(21,22)10-6-4-9(5-7-10)15(17)20/h1-8,18-19H,(H2,17,20)
InChIKeyUQEUNMCUNMWMBX-UHFFFAOYSA-N
XLogP2.72
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.80
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide?
The IUPAC name of 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide (CID 10665503) is 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide.
What is the SMILES notation for 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide?
The canonical SMILES for 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)Nc2cccc3c(Cl)c[nH]c23)cc1.
What is the InChIKey of 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide?
The InChIKey is UQEUNMCUNMWMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O3S/c16-12-8-18-14-11(12)2-1-3-13(14)19-23(21,22)10-6-4-9(5-7-10)15(17)20/h1-8,18-19H,(H2,17,20).
What are the key properties of 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide?
4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide has a molecular weight of 349.80 g/mol, XLogP of 2.72, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-chloro-1H-indol-7-yl)sulfamoyl]benzamide is sourced from PubChem (CID 10665503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).