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

C15H14N4O4S — CID 2956331

IUPACN-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C15H14N4O4S/c1-9(20)16-10-2-4-11(5-3-10)19-24(22,23)12-6-7-13-14(8-12)18-15(21)17-13/h2-8,19H,1H3,(H,16,20)(H2,17,18,21)
InChIKeyZTGOWRZXHUMKTP-UHFFFAOYSA-N
MW346.37 g/mol
LogP1.62
Rot. Bonds4

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

N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide (PubChem CID 2956331) 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)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide
PubChem CID2956331
Molecular FormulaC15H14N4O4S
Molecular Weight346.37 g/mol
Exact Mass346.07
IUPAC NameN-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1
InChIInChI=1S/C15H14N4O4S/c1-9(20)16-10-2-4-11(5-3-10)19-24(22,23)12-6-7-13-14(8-12)18-15(21)17-13/h2-8,19H,1H3,(H,16,20)(H2,17,18,21)
InChIKeyZTGOWRZXHUMKTP-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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Related Compounds

N-(3-methoxypropyl)-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 16193893
2,3-Dihydro-2-oxo-1-propyl-1H-benzimidazole-5-sulfonamide
CID 28819101
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 1094882
2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide
CID 719684
N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfamoyl]phenyl]acetamide
CID 2103499
N-(2,5-dimethylphenyl)-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 7113285
2-oxo-N-(p-tolyl)-2,3-dihydro-1H-benzo[d]imidazole-5-sulfonamide
CID 7454312
N-(4-fluorophenyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 701109
N-(4-ethylphenyl)-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 889455
5-(Pyrrolidine-1-sulfonyl)-1,3-dihydro-benzoimidazol-2-one
CID 893000
5-(4-Methylpiperidin-1-yl)sulfonyl-1,3-dihydrobenzimidazol-2-one
CID 2956749
N-methyl-2-oxo-N-phenyl-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 2957874

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide (CID 2956331) is N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide is CC(=O)Nc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1.
What is the InChIKey of N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]phenyl]acetamide?
The InChIKey is ZTGOWRZXHUMKTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O4S/c1-9(20)16-10-2-4-11(5-3-10)19-24(22,23)12-6-7-13-14(8-12)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)sulfonylamino]phenyl]acetamide?
N-[4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]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)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 2956331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).