1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea

C16H19N3O4S — CID 6470771

IUPAC1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea
SMILESCCNS(=O)(=O)c1ccc(NC(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C16H19N3O4S/c1-3-17-24(21,22)13-10-8-12(9-11-13)18-16(20)19-14-6-4-5-7-15(14)23-2/h4-11,17H,3H2,1-2H3,(H2,18,19,20)
InChIKeyDXZLSMGLHXZULE-UHFFFAOYSA-N
MW349.41 g/mol
LogP2.64
Rot. Bonds6

About 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea

1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea (PubChem CID 6470771) has the molecular formula C16H19N3O4S and a molecular weight of 349.41 g/mol. Its IUPAC name is 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea
PubChem CID6470771
Molecular FormulaC16H19N3O4S
Molecular Weight349.41 g/mol
Exact Mass349.11
IUPAC Name1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea
SMILESCCNS(=O)(=O)c1ccc(NC(=O)Nc2ccccc2OC)cc1
InChIInChI=1S/C16H19N3O4S/c1-3-17-24(21,22)13-10-8-12(9-11-13)18-16(20)19-14-6-4-5-7-15(14)23-2/h4-11,17H,3H2,1-2H3,(H2,18,19,20)
InChIKeyDXZLSMGLHXZULE-UHFFFAOYSA-N
XLogP2.64
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 52.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea 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-[(2-Ethoxyphenyl)carbamoylamino]phenyl] sulfamate
CID 70696644
N4-Acetyl-N1-(2-methoxyphenyl)sulfanilamide
CID 668310
4-(3-(4-Butoxyphenyl)ureido)benzenesulfonamide
CID 50942416
1-(1,1-Dioxidotetrahydrothiophen-3-yl)-3-(2-methoxyphenyl)urea
CID 3152350
1-Cyclohexyl-3-(2-methoxyphenyl)urea
CID 307293
T-900607
CID 9812416
1-(2-Methoxyphenyl)-3-(2-oxidanyl-5-sulfamoyl-phenyl)urea
CID 134817798
4-Fluoro-N-{4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-benzenesulfonamide
CID 44403225
1-[(4-Methoxyphenyl)sulfonylamino]-3-(4-sulfamoylphenyl)urea
CID 118710605
3-{[(2-ethoxyanilino)carbonyl]amino}-N,N,4-trimethylbenzenesulfonamide
CID 2812297
N-(2-Ethoxyphenyl)-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide
CID 7586546
1-(2-Ethoxyphenyl)-3-(4-methylphenyl)sulfonylurea
CID 753422

Frequently Asked Questions

What is the IUPAC name of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea (CID 6470771) is 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea is CCNS(=O)(=O)c1ccc(NC(=O)Nc2ccccc2OC)cc1.
What is the InChIKey of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea?
The InChIKey is DXZLSMGLHXZULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4S/c1-3-17-24(21,22)13-10-8-12(9-11-13)18-16(20)19-14-6-4-5-7-15(14)23-2/h4-11,17H,3H2,1-2H3,(H2,18,19,20).
What are the key properties of 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea?
1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea has a molecular weight of 349.41 g/mol, XLogP of 2.64, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(ethylsulfamoyl)phenyl]-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 6470771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).