4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide

C16H15ClN2O3S — CID 4880260

IUPAC4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cc(C(=O)Nc2ccc3c(c2)CCC3)ccc1Cl
InChIInChI=1S/C16H15ClN2O3S/c17-14-7-5-12(9-15(14)23(18,21)22)16(20)19-13-6-4-10-2-1-3-11(10)8-13/h4-9H,1-3H2,(H,19,20)(H2,18,21,22)
InChIKeyODJLRXBNFLFJCD-UHFFFAOYSA-N
MW350.83 g/mol
LogP2.73
Rot. Bonds3

About 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide

4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide (PubChem CID 4880260) has the molecular formula C16H15ClN2O3S and a molecular weight of 350.83 g/mol. Its IUPAC name is 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide.

Molecular Properties

Compound Name4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide
PubChem CID4880260
Molecular FormulaC16H15ClN2O3S
Molecular Weight350.83 g/mol
Exact Mass350.05
IUPAC Name4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cc(C(=O)Nc2ccc3c(c2)CCC3)ccc1Cl
InChIInChI=1S/C16H15ClN2O3S/c17-14-7-5-12(9-15(14)23(18,21)22)16(20)19-13-6-4-10-2-1-3-11(10)8-13/h4-9H,1-3H2,(H,19,20)(H2,18,21,22)
InChIKeyODJLRXBNFLFJCD-UHFFFAOYSA-N
XLogP2.73
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.83
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide?
The IUPAC name of 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide (CID 4880260) is 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide.
What is the SMILES notation for 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide?
The canonical SMILES for 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide is NS(=O)(=O)c1cc(C(=O)Nc2ccc3c(c2)CCC3)ccc1Cl.
What is the InChIKey of 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide?
The InChIKey is ODJLRXBNFLFJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3S/c17-14-7-5-12(9-15(14)23(18,21)22)16(20)19-13-6-4-10-2-1-3-11(10)8-13/h4-9H,1-3H2,(H,19,20)(H2,18,21,22).
What are the key properties of 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide?
4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide has a molecular weight of 350.83 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-3-sulfamoylbenzamide is sourced from PubChem (CID 4880260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).