N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide

C15H15N3O5S — CID 7586552

IUPACN-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)c(OC)c1
InChIInChI=1S/C15H15N3O5S/c1-22-9-3-5-12(14(7-9)23-2)18-24(20,21)10-4-6-11-13(8-10)17-15(19)16-11/h3-8,18H,1-2H3,(H2,16,17,19)
InChIKeyGSNFJDVSSOLMTF-UHFFFAOYSA-N
MW349.37 g/mol
LogP1.67
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide

N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide (PubChem CID 7586552) has the molecular formula C15H15N3O5S and a molecular weight of 349.37 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
PubChem CID7586552
Molecular FormulaC15H15N3O5S
Molecular Weight349.37 g/mol
Exact Mass349.07
IUPAC NameN-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)c(OC)c1
InChIInChI=1S/C15H15N3O5S/c1-22-9-3-5-12(14(7-9)23-2)18-24(20,21)10-4-6-11-13(8-10)17-15(19)16-11/h3-8,18H,1-2H3,(H2,16,17,19)
InChIKeyGSNFJDVSSOLMTF-UHFFFAOYSA-N
XLogP1.67
TPSA113.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-chloro-2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 7602669
N-[(2,4-dimethoxyphenyl)methyl]-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide
CID 46673539
N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide
CID 46764272
ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one
CID 143892741
N-[(3,5-dimethoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 110672585
N-(2,4-dimethoxyphenyl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 7161235
4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide
CID 7940687
5-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CID 9190196
N-(4-methoxy-2-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 22202548
(3-methoxyphenyl) 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate
CID 71902122
N-(2,5-dimethoxyphenyl)-3,5-dimethoxybenzenesulfonamide
CID 24989180
3,4-dimethyl-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzenesulfonamide
CID 20961997

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide (CID 7586552) is N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide is COc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
The InChIKey is GSNFJDVSSOLMTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O5S/c1-22-9-3-5-12(14(7-9)23-2)18-24(20,21)10-4-6-11-13(8-10)17-15(19)16-11/h3-8,18H,1-2H3,(H2,16,17,19).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide has a molecular weight of 349.37 g/mol, XLogP of 1.67, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide is sourced from PubChem (CID 7586552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).