N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide

C15H14N4O4S — CID 2103499

IUPACN-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C15H14N4O4S/c1-9(20)16-10-2-5-12(6-3-10)24(22,23)19-11-4-7-13-14(8-11)18-15(21)17-13/h2-8,19H,1H3,(H,16,20)(H2,17,18,21)
InChIKeyXOXYUXWXHJOUCK-UHFFFAOYSA-N
MW346.37 g/mol
LogP1.62
Rot. Bonds4

About N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide

N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide (PubChem CID 2103499) has the molecular formula C15H14N4O4S and a molecular weight of 346.37 g/mol. Its IUPAC name is N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide
PubChem CID2103499
Molecular FormulaC15H14N4O4S
Molecular Weight346.37 g/mol
Exact Mass346.07
IUPAC NameN-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C15H14N4O4S/c1-9(20)16-10-2-5-12(6-3-10)24(22,23)19-11-4-7-13-14(8-11)18-15(21)17-13/h2-8,19H,1H3,(H,16,20)(H2,17,18,21)
InChIKeyXOXYUXWXHJOUCK-UHFFFAOYSA-N
XLogP1.62
TPSA123.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.37
LogP ≤ 51.62
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide (CID 2103499) is N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1.
What is the InChIKey of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is XOXYUXWXHJOUCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O4S/c1-9(20)16-10-2-5-12(6-3-10)24(22,23)19-11-4-7-13-14(8-11)18-15(21)17-13/h2-8,19H,1H3,(H,16,20)(H2,17,18,21).
What are the key properties of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide?
N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 346.37 g/mol, XLogP of 1.62, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 2103499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).