2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide

C11H10BrN3O4S — CID 106853237

IUPAC2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide
SMILESNS(=O)(=O)Nc1cccc(NC(=O)c2ccoc2Br)c1
InChIInChI=1S/C11H10BrN3O4S/c12-10-9(4-5-19-10)11(16)14-7-2-1-3-8(6-7)15-20(13,17)18/h1-6,15H,(H,14,16)(H2,13,17,18)
InChIKeyKMLQAMZHOCAZPJ-UHFFFAOYSA-N
MW360.19 g/mol
LogP1.91
Rot. Bonds4

About 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide

2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide (PubChem CID 106853237) has the molecular formula C11H10BrN3O4S and a molecular weight of 360.19 g/mol. Its IUPAC name is 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide
PubChem CID106853237
Molecular FormulaC11H10BrN3O4S
Molecular Weight360.19 g/mol
Exact Mass358.96
IUPAC Name2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide
SMILESNS(=O)(=O)Nc1cccc(NC(=O)c2ccoc2Br)c1
InChIInChI=1S/C11H10BrN3O4S/c12-10-9(4-5-19-10)11(16)14-7-2-1-3-8(6-7)15-20(13,17)18/h1-6,15H,(H,14,16)(H2,13,17,18)
InChIKeyKMLQAMZHOCAZPJ-UHFFFAOYSA-N
XLogP1.91
TPSA114.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.19
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-(3-methylphenyl)furan-3-carboxamide
CID 106852319
3-methyl-N-[3-(sulfamoylamino)phenyl]furan-2-carboxamide
CID 60728536
2-bromo-N-[3-(sulfamoylamino)phenyl]pyridine-4-carboxamide
CID 103754216
2-bromo-N-[3-(dimethylsulfamoyl)phenyl]furan-3-carboxamide
CID 106852841
2-iodo-N-[3-(sulfamoylamino)phenyl]benzamide
CID 60729880
6-oxo-N-[3-(sulfamoylamino)phenyl]pyran-3-carboxamide
CID 61130491
5-chloro-N-[3-(sulfamoylamino)phenyl]furan-2-carboxamide
CID 60727989
3-chloro-N-[3-(sulfamoylamino)phenyl]benzamide
CID 60729874
N-[3-(sulfamoylamino)phenyl]thiophene-3-carboxamide
CID 60728385
2-bromo-N-[3-chloro-4-(methanesulfonamido)phenyl]furan-3-carboxamide
CID 106853250
2-bromo-N-(6-bromonaphthalen-2-yl)furan-3-carboxamide
CID 106852301
5-bromo-N-[3-(sulfamoylamino)phenyl]pentanamide
CID 107908922

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide?
The IUPAC name of 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide (CID 106853237) is 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide.
What is the SMILES notation for 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide?
The canonical SMILES for 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide is NS(=O)(=O)Nc1cccc(NC(=O)c2ccoc2Br)c1.
What is the InChIKey of 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide?
The InChIKey is KMLQAMZHOCAZPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrN3O4S/c12-10-9(4-5-19-10)11(16)14-7-2-1-3-8(6-7)15-20(13,17)18/h1-6,15H,(H,14,16)(H2,13,17,18).
What are the key properties of 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide?
2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide has a molecular weight of 360.19 g/mol, XLogP of 1.91, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-[3-(sulfamoylamino)phenyl]furan-3-carboxamide is sourced from PubChem (CID 106853237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).