5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide

C10H10BrNO2S3 — CID 62844793

IUPAC5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(Br)s1)c1ccsc1
InChIInChI=1S/C10H10BrNO2S3/c1-7(8-4-5-15-6-8)12-17(13,14)10-3-2-9(11)16-10/h2-7,12H,1H3
InChIKeyAMWHJLWPNPFLFV-UHFFFAOYSA-N
MW352.30 g/mol
LogP3.61
Rot. Bonds4

About 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide

5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide (PubChem CID 62844793) has the molecular formula C10H10BrNO2S3 and a molecular weight of 352.30 g/mol. Its IUPAC name is 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide
PubChem CID62844793
Molecular FormulaC10H10BrNO2S3
Molecular Weight352.30 g/mol
Exact Mass350.91
IUPAC Name5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(Br)s1)c1ccsc1
InChIInChI=1S/C10H10BrNO2S3/c1-7(8-4-5-15-6-8)12-17(13,14)10-3-2-9(11)16-10/h2-7,12H,1H3
InChIKeyAMWHJLWPNPFLFV-UHFFFAOYSA-N
XLogP3.61
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.30
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-aminophenyl)ethyl]-5-bromothiophene-2-sulfonamide
CID 43297909
4-bromo-N-(1-thiophen-3-ylethyl)benzenesulfonamide
CID 62844441
5-bromo-N-(1-thiophen-2-ylethyl)thiophene-2-sulfonamide
CID 51169859
N-[1-(3-aminophenyl)ethyl]-5-bromothiophene-2-sulfonamide
CID 43297962
N-(1-thiophen-3-ylethyl)propane-2-sulfonamide
CID 64586301
4-bromo-3-methyl-N-(1-thiophen-3-ylethyl)benzenesulfonamide
CID 62844268
5-(aminomethyl)-4-methyl-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide
CID 106056610
5-bromo-N-[(2R)-butan-2-yl]thiophene-2-sulfonamide
CID 848230
4-[1-(methylamino)ethyl]-N-(1-thiophen-3-ylethyl)benzenesulfonamide
CID 62844597
5-bromo-N-(1-cyclopropylethyl)thiophene-2-sulfonamide
CID 55029070
4-(methylamino)-N-(1-thiophen-3-ylethyl)benzenesulfonamide
CID 55130085
5-bromo-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]thiophene-2-sulfonamide
CID 112697358

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide (CID 62844793) is 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide is CC(NS(=O)(=O)c1ccc(Br)s1)c1ccsc1.
What is the InChIKey of 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide?
The InChIKey is AMWHJLWPNPFLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrNO2S3/c1-7(8-4-5-15-6-8)12-17(13,14)10-3-2-9(11)16-10/h2-7,12H,1H3.
What are the key properties of 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide?
5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide has a molecular weight of 352.30 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1-thiophen-3-ylethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 62844793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).