4-chloro-3-(sulfamoylamino)benzamide

C7H8ClN3O3S — CID 112573335

IUPAC4-chloro-3-(sulfamoylamino)benzamide
SMILESNC(=O)c1ccc(Cl)c(NS(N)(=O)=O)c1
InChIInChI=1S/C7H8ClN3O3S/c8-5-2-1-4(7(9)12)3-6(5)11-15(10,13)14/h1-3,11H,(H2,9,12)(H2,10,13,14)
InChIKeyZDBDEAPLWVIYNP-UHFFFAOYSA-N
MW249.68 g/mol
LogP0.05
Rot. Bonds3

About 4-chloro-3-(sulfamoylamino)benzamide

4-chloro-3-(sulfamoylamino)benzamide (PubChem CID 112573335) has the molecular formula C7H8ClN3O3S and a molecular weight of 249.68 g/mol. Its IUPAC name is 4-chloro-3-(sulfamoylamino)benzamide.

Molecular Properties

Compound Name4-chloro-3-(sulfamoylamino)benzamide
PubChem CID112573335
Molecular FormulaC7H8ClN3O3S
Molecular Weight249.68 g/mol
Exact Mass249.00
IUPAC Name4-chloro-3-(sulfamoylamino)benzamide
SMILESNC(=O)c1ccc(Cl)c(NS(N)(=O)=O)c1
InChIInChI=1S/C7H8ClN3O3S/c8-5-2-1-4(7(9)12)3-6(5)11-15(10,13)14/h1-3,11H,(H2,9,12)(H2,10,13,14)
InChIKeyZDBDEAPLWVIYNP-UHFFFAOYSA-N
XLogP0.05
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.68
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-3-(sulfamoylamino)benzenecarbothioamide
CID 114959203
4-chloro-3-[(2,5-dichlorothiophen-3-yl)sulfonylamino]benzamide
CID 34973303
4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide
CID 62999668
4-chloro-3-[(4-chloro-2-methylphenyl)sulfonylamino]benzamide
CID 60531609
3-(carbamothioylamino)-4-chlorobenzamide
CID 86665570
1-chloro-4-methyl-2-(sulfamoylamino)benzene
CID 107638348
3-(sulfamoylamino)benzamide
CID 57051238
3-[(1-aminocyclopropanecarbonyl)amino]-4-chlorobenzamide
CID 65464421
3-chloro-4-hydroxybenzamide
CID 22932347
N-(5-acetyl-2-chlorophenyl)-2,4,5-trichlorobenzenesulfonamide
CID 2742129
4-chloro-3-(pentylamino)benzamide
CID 43679378
4-chloro-3-[[2-(4-chlorophenyl)acetyl]amino]benzamide
CID 50875886

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(sulfamoylamino)benzamide?
The IUPAC name of 4-chloro-3-(sulfamoylamino)benzamide (CID 112573335) is 4-chloro-3-(sulfamoylamino)benzamide.
What is the SMILES notation for 4-chloro-3-(sulfamoylamino)benzamide?
The canonical SMILES for 4-chloro-3-(sulfamoylamino)benzamide is NC(=O)c1ccc(Cl)c(NS(N)(=O)=O)c1.
What is the InChIKey of 4-chloro-3-(sulfamoylamino)benzamide?
The InChIKey is ZDBDEAPLWVIYNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClN3O3S/c8-5-2-1-4(7(9)12)3-6(5)11-15(10,13)14/h1-3,11H,(H2,9,12)(H2,10,13,14).
What are the key properties of 4-chloro-3-(sulfamoylamino)benzamide?
4-chloro-3-(sulfamoylamino)benzamide has a molecular weight of 249.68 g/mol, XLogP of 0.05, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(sulfamoylamino)benzamide is sourced from PubChem (CID 112573335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).