1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea

C17H15Cl2N3O3S — CID 67684530

IUPAC1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea
SMILESCCn1ccc2ccc(S(=O)(=O)NC(=O)Nc3ccc(Cl)c(Cl)c3)cc21
InChIInChI=1S/C17H15Cl2N3O3S/c1-2-22-8-7-11-3-5-13(10-16(11)22)26(24,25)21-17(23)20-12-4-6-14(18)15(19)9-12/h3-10H,2H2,1H3,(H2,20,21,23)
InChIKeyQAFMHIDYTYFRGB-UHFFFAOYSA-N
MW412.30 g/mol
LogP4.48
Rot. Bonds4

About 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea

1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea (PubChem CID 67684530) has the molecular formula C17H15Cl2N3O3S and a molecular weight of 412.30 g/mol. Its IUPAC name is 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea.

Molecular Properties

Compound Name1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea
PubChem CID67684530
Molecular FormulaC17H15Cl2N3O3S
Molecular Weight412.30 g/mol
Exact Mass411.02
IUPAC Name1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea
SMILESCCn1ccc2ccc(S(=O)(=O)NC(=O)Nc3ccc(Cl)c(Cl)c3)cc21
InChIInChI=1S/C17H15Cl2N3O3S/c1-2-22-8-7-11-3-5-13(10-16(11)22)26(24,25)21-17(23)20-12-4-6-14(18)15(19)9-12/h3-10H,2H2,1H3,(H2,20,21,23)
InChIKeyQAFMHIDYTYFRGB-UHFFFAOYSA-N
XLogP4.48
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.30
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea 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-ethylindol-6-yl)-3-(1-hydroxypentan-3-yl)urea
CID 111474945
N-(1-ethylindol-6-yl)pyrrolidine-1-carboxamide
CID 71874521
3-(1-ethylindol-6-yl)-1-(2-hydroxy-2-methylpropyl)-1-methylurea
CID 111754908
1-(3,4-dichlorophenyl)-3-thiophen-2-ylsulfonylurea
CID 19089331
N-[4-(acetylsulfamoyl)phenyl]-2-(6-fluoroindol-1-yl)acetamide
CID 29136353
2-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanyl-N-(3,4-dichlorophenyl)acetamide
CID 1211554
N-[3-(naphthalen-2-ylcarbamoylsulfamoyl)phenyl]acetamide
CID 139878374
1-[3-[(3,4-dichlorophenyl)sulfonylamino]phenyl]-3-methylurea
CID 36511529
1-(1-ethylindol-6-yl)-3-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]urea
CID 86816676
1-(1-ethylindol-6-yl)-3-[2-hydroxy-3-(2-methylpropoxy)propyl]urea
CID 111474953
1-(3,4-dichlorophenyl)-3-[5-(diethylsulfamoyl)-2-methoxyphenyl]urea
CID 2963637
3-chloro-5-[(1-ethylindol-5-yl)sulfamoyl]-2-hydroxybenzamide
CID 130406144

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea?
The IUPAC name of 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea (CID 67684530) is 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea.
What is the SMILES notation for 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea?
The canonical SMILES for 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea is CCn1ccc2ccc(S(=O)(=O)NC(=O)Nc3ccc(Cl)c(Cl)c3)cc21.
What is the InChIKey of 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea?
The InChIKey is QAFMHIDYTYFRGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N3O3S/c1-2-22-8-7-11-3-5-13(10-16(11)22)26(24,25)21-17(23)20-12-4-6-14(18)15(19)9-12/h3-10H,2H2,1H3,(H2,20,21,23).
What are the key properties of 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea?
1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea has a molecular weight of 412.30 g/mol, XLogP of 4.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dichlorophenyl)-3-(1-ethylindol-6-yl)sulfonylurea is sourced from PubChem (CID 67684530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).