5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide

C14H12N4O4S — CID 130406204

IUPAC5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide
SMILESNC(=O)c1cc(S(=O)(=O)Nc2ccc3nc[nH]c3c2)ccc1O
InChIInChI=1S/C14H12N4O4S/c15-14(20)10-6-9(2-4-13(10)19)23(21,22)18-8-1-3-11-12(5-8)17-7-16-11/h1-7,18-19H,(H2,15,20)(H,16,17)
InChIKeyNFDIYGBKACYCGD-UHFFFAOYSA-N
MW332.34 g/mol
LogP1.17
Rot. Bonds4

About 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide

5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide (PubChem CID 130406204) has the molecular formula C14H12N4O4S and a molecular weight of 332.34 g/mol. Its IUPAC name is 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide
PubChem CID130406204
Molecular FormulaC14H12N4O4S
Molecular Weight332.34 g/mol
Exact Mass332.06
IUPAC Name5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide
SMILESNC(=O)c1cc(S(=O)(=O)Nc2ccc3nc[nH]c3c2)ccc1O
InChIInChI=1S/C14H12N4O4S/c15-14(20)10-6-9(2-4-13(10)19)23(21,22)18-8-1-3-11-12(5-8)17-7-16-11/h1-7,18-19H,(H2,15,20)(H,16,17)
InChIKeyNFDIYGBKACYCGD-UHFFFAOYSA-N
XLogP1.17
TPSA138.17 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.34
LogP ≤ 51.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide?
The IUPAC name of 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide (CID 130406204) is 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide.
What is the SMILES notation for 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide?
The canonical SMILES for 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide is NC(=O)c1cc(S(=O)(=O)Nc2ccc3nc[nH]c3c2)ccc1O.
What is the InChIKey of 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide?
The InChIKey is NFDIYGBKACYCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O4S/c15-14(20)10-6-9(2-4-13(10)19)23(21,22)18-8-1-3-11-12(5-8)17-7-16-11/h1-7,18-19H,(H2,15,20)(H,16,17).
What are the key properties of 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide?
5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide has a molecular weight of 332.34 g/mol, XLogP of 1.17, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3H-benzimidazol-5-ylsulfamoyl)-2-hydroxybenzamide is sourced from PubChem (CID 130406204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).