5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid

C10H7BrN2O5S — CID 29077659

IUPAC5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)Nc2ccc(Br)cn2)o1
InChIInChI=1S/C10H7BrN2O5S/c11-6-1-3-8(12-5-6)13-19(16,17)9-4-2-7(18-9)10(14)15/h1-5H,(H,12,13)(H,14,15)
InChIKeyCMNFKGRWPLBOTH-UHFFFAOYSA-N
MW347.15 g/mol
LogP1.94
Rot. Bonds4

About 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid

5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid (PubChem CID 29077659) has the molecular formula C10H7BrN2O5S and a molecular weight of 347.15 g/mol. Its IUPAC name is 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid.

Molecular Properties

Compound Name5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid
PubChem CID29077659
Molecular FormulaC10H7BrN2O5S
Molecular Weight347.15 g/mol
Exact Mass345.93
IUPAC Name5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid
SMILESO=C(O)c1ccc(S(=O)(=O)Nc2ccc(Br)cn2)o1
InChIInChI=1S/C10H7BrN2O5S/c11-6-1-3-8(12-5-6)13-19(16,17)9-4-2-7(18-9)10(14)15/h1-5H,(H,12,13)(H,14,15)
InChIKeyCMNFKGRWPLBOTH-UHFFFAOYSA-N
XLogP1.94
TPSA109.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.15
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-4-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid
CID 62803639
5-(pyridin-2-ylsulfamoyl)furan-2-carboxylic acid
CID 1322341
4-bromo-N-(5-bromo-2-pyridinyl)benzenesulfonamide
CID 3811085
5-(pyridin-4-ylsulfamoyl)furan-2-carboxylic acid
CID 29077337
N-(5-bromo-2-pyridinyl)-4-methylbenzenesulfonamide
CID 673877
3-amino-4-[(5-bromo-2-pyridinyl)sulfamoyl]benzoic acid
CID 81465963
5-[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]sulfanylfuran-2-carboxylic acid
CID 63942163
4-[(5-bromo-2-pyridinyl)sulfamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid
CID 81428200
5-[(3-bromo-4-fluorophenyl)sulfamoyl]furan-2-carboxylic acid
CID 104775672
5-[(3-bromo-2-methylphenyl)sulfamoyl]furan-2-carboxylic acid
CID 107624822
N-(5-bromo-2-pyridinyl)methanesulfonamide
CID 790872
3-[4-[(5-bromo-2-pyridinyl)sulfamoyl]pyrazol-1-yl]propanoic acid
CID 43513657

Frequently Asked Questions

What is the IUPAC name of 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid?
The IUPAC name of 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid (CID 29077659) is 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid.
What is the SMILES notation for 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid?
The canonical SMILES for 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid is O=C(O)c1ccc(S(=O)(=O)Nc2ccc(Br)cn2)o1.
What is the InChIKey of 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid?
The InChIKey is CMNFKGRWPLBOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN2O5S/c11-6-1-3-8(12-5-6)13-19(16,17)9-4-2-7(18-9)10(14)15/h1-5H,(H,12,13)(H,14,15).
What are the key properties of 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid?
5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid has a molecular weight of 347.15 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-bromo-2-pyridinyl)sulfamoyl]furan-2-carboxylic acid is sourced from PubChem (CID 29077659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).