N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide

C15H12ClN3O3S — CID 10915071

IUPACN-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)Nc2cccc3c(Cl)c[nH]c23)cc1
InChIInChI=1S/C15H12ClN3O3S/c16-12-8-18-14-11(12)2-1-3-13(14)19-15(20)9-4-6-10(7-5-9)23(17,21)22/h1-8,18H,(H,19,20)(H2,17,21,22)
InChIKeyVZDFJEKHHUVAJY-UHFFFAOYSA-N
MW349.80 g/mol
LogP2.72
Rot. Bonds3

About N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide

N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide (PubChem CID 10915071) has the molecular formula C15H12ClN3O3S and a molecular weight of 349.80 g/mol. Its IUPAC name is N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide
PubChem CID10915071
Molecular FormulaC15H12ClN3O3S
Molecular Weight349.80 g/mol
Exact Mass349.03
IUPAC NameN-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)Nc2cccc3c(Cl)c[nH]c23)cc1
InChIInChI=1S/C15H12ClN3O3S/c16-12-8-18-14-11(12)2-1-3-13(14)19-15(20)9-4-6-10(7-5-9)23(17,21)22/h1-8,18H,(H,19,20)(H2,17,21,22)
InChIKeyVZDFJEKHHUVAJY-UHFFFAOYSA-N
XLogP2.72
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
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 N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide?
The IUPAC name of N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide (CID 10915071) is N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide.
What is the SMILES notation for N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide?
The canonical SMILES for N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide is NS(=O)(=O)c1ccc(C(=O)Nc2cccc3c(Cl)c[nH]c23)cc1.
What is the InChIKey of N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide?
The InChIKey is VZDFJEKHHUVAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O3S/c16-12-8-18-14-11(12)2-1-3-13(14)19-15(20)9-4-6-10(7-5-9)23(17,21)22/h1-8,18H,(H,19,20)(H2,17,21,22).
What are the key properties of N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide?
N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide has a molecular weight of 349.80 g/mol, XLogP of 2.72, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-1H-indol-7-yl)-4-sulfamoylbenzamide is sourced from PubChem (CID 10915071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).