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

C15H15N3O4S — CID 7586546

IUPACN-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H15N3O4S/c1-2-22-14-6-4-3-5-12(14)18-23(20,21)10-7-8-11-13(9-10)17-15(19)16-11/h3-9,18H,2H2,1H3,(H2,16,17,19)
InChIKeyVCMWKECPLMWELN-UHFFFAOYSA-N
MW333.37 g/mol
LogP2.06
Rot. Bonds5

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

N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide (PubChem CID 7586546) has the molecular formula C15H15N3O4S and a molecular weight of 333.37 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
PubChem CID7586546
Molecular FormulaC15H15N3O4S
Molecular Weight333.37 g/mol
Exact Mass333.08
IUPAC NameN-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H15N3O4S/c1-2-22-14-6-4-3-5-12(14)18-23(20,21)10-7-8-11-13(9-10)17-15(19)16-11/h3-9,18H,2H2,1H3,(H2,16,17,19)
InChIKeyVCMWKECPLMWELN-UHFFFAOYSA-N
XLogP2.06
TPSA104.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 52.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-(4-Butoxyphenyl)ureido)benzenesulfonamide
CID 50942416
N-(4-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 2957824
N-(3,4-dimethoxyphenyl)-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide
CID 8582580
1,3-diethyl-6-methyl-2-oxo-N-(2-phenoxyethyl)-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 2229203
3-(2-Methoxyphenyl)-1-(4-sulfamoylphenyl)urea
CID 307522
N-(2-methoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
CID 53372216
N-(4-Methoxyphenyl)-1,3-dimethyl-2-oxo-1,3-benzodiazole-5-sulfonamide
CID 1093431
1,3-Dimethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-sulfonic acid (2-methoxy-phenyl)-amide
CID 1093433
N-(2-methoxy-5-methylphenyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazole-5-sulfonamide
CID 1242527
4-({[(2-Ethoxyphenyl)amino]carbonothioyl}amino)benzenesulfonamide
CID 2204716
1-[3-[(2-Methoxyphenyl)sulfamoyl]phenyl]-3-phenylurea
CID 4143693
N-(4-ethoxyphenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 5309599

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide (CID 7586546) is N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide is CCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
The InChIKey is VCMWKECPLMWELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O4S/c1-2-22-14-6-4-3-5-12(14)18-23(20,21)10-7-8-11-13(9-10)17-15(19)16-11/h3-9,18H,2H2,1H3,(H2,16,17,19).
What are the key properties of N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide?
N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide has a molecular weight of 333.37 g/mol, XLogP of 2.06, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide is sourced from PubChem (CID 7586546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).