N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

C19H23N3O4S — CID 53372868

IUPACN-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESCCCCOc1ccc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc1
InChIInChI=1S/C19H23N3O4S/c1-2-3-14-26-17-8-4-15(5-9-17)21-27(24,25)18-10-6-16(7-11-18)22-13-12-20-19(22)23/h4-11,21H,2-3,12-14H2,1H3,(H,20,23)
InChIKeyRNTXBYMCMBDSJK-UHFFFAOYSA-N
MW389.48 g/mol
LogP3.20
Rot. Bonds8

About N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (PubChem CID 53372868) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
PubChem CID53372868
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC NameN-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESCCCCOc1ccc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc1
InChIInChI=1S/C19H23N3O4S/c1-2-3-14-26-17-8-4-15(5-9-17)21-27(24,25)18-10-6-16(7-11-18)22-13-12-20-19(22)23/h4-11,21H,2-3,12-14H2,1H3,(H,20,23)
InChIKeyRNTXBYMCMBDSJK-UHFFFAOYSA-N
XLogP3.20
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide 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

1-(1-(Phenylsulfonyl)piperidin-4-yl)-3-(4-(trifluoromethoxy)phenyl)urea
CID 49780370
4-(3-(4-Butoxyphenyl)ureido)benzenesulfonamide
CID 50942416
3-amino-N-(4-methoxyphenyl)-4-(pyrrolidin-1-yl)benzene-1-sulfonamide
CID 3674642
2-(carbamoylamino)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-methylsulfanylbutanamide
CID 3930725
N-(4-ethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 2957824
2-(carbamoylamino)-N-[5-[(4-methoxyphenyl)sulfamoyl]-2-piperidin-1-ylphenyl]propanamide
CID 4291895
1-(4-Ethoxyphenyl)-3-[1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]urea
CID 16194672
4-(2-oxo-1-pyrrolidinyl)-N-(2-phenoxyethyl)benzenesulfonamide
CID 1811239
N-(4-ethoxyphenyl)-N'-[3-(1-pyrrolidinyl)propyl]urea
CID 2198296
N-(4-{[1-(4-methoxyphenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]sulfamoyl}phenyl)acetamide
CID 2965073
N-(4-Ethoxyphenyl)-3-[4-(4-methoxybenzenesulfonyl)piperazin-1-YL]propanamide
CID 9550798
1-Phenyl-3-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]sulfonylurea
CID 60145776

Frequently Asked Questions

What is the IUPAC name of N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (CID 53372868) is N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is CCCCOc1ccc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc1.
What is the InChIKey of N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The InChIKey is RNTXBYMCMBDSJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-2-3-14-26-17-8-4-15(5-9-17)21-27(24,25)18-10-6-16(7-11-18)22-13-12-20-19(22)23/h4-11,21H,2-3,12-14H2,1H3,(H,20,23).
What are the key properties of N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide has a molecular weight of 389.48 g/mol, XLogP of 3.20, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butoxyphenyl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 53372868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).