5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide

C13H9ClN2O3S2 — CID 110402158

IUPAC5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1oncc1-c1ccccc1)c1ccc(Cl)s1
InChIInChI=1S/C13H9ClN2O3S2/c14-11-6-7-12(20-11)21(17,18)16-13-10(8-15-19-13)9-4-2-1-3-5-9/h1-8,16H
InChIKeyQVCNXDXGLVJECD-UHFFFAOYSA-N
MW340.81 g/mol
LogP3.86
Rot. Bonds4

About 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide

5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide (PubChem CID 110402158) has the molecular formula C13H9ClN2O3S2 and a molecular weight of 340.81 g/mol. Its IUPAC name is 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
PubChem CID110402158
Molecular FormulaC13H9ClN2O3S2
Molecular Weight340.81 g/mol
Exact Mass339.97
IUPAC Name5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1oncc1-c1ccccc1)c1ccc(Cl)s1
InChIInChI=1S/C13H9ClN2O3S2/c14-11-6-7-12(20-11)21(17,18)16-13-10(8-15-19-13)9-4-2-1-3-5-9/h1-8,16H
InChIKeyQVCNXDXGLVJECD-UHFFFAOYSA-N
XLogP3.86
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-(5-phenyl-2-pyridinyl)thiophene-2-sulfonamide
CID 110634676
3-methyl-N-(4-phenyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 110402160
5-chloro-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 19683573
N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]thiophene-2-sulfonamide
CID 110402463
N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-1-phenylmethanesulfonamide
CID 110402597
N-(4-phenyl-1,2-oxazol-5-yl)butane-1-sulfonamide
CID 110402127
5-chloro-N-(2-chloro-3-pyridinyl)thiophene-2-sulfonamide
CID 4729238
5-chloro-N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
CID 112986155
5-chloro-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]thiophene-2-sulfonamide
CID 110314704
2-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid
CID 4739578
3-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-2-carboxylic acid
CID 113341680
N-[4-(1,3-benzothiazol-2-yl)-1,2-oxazol-5-yl]-4-(4-chlorophenyl)benzenesulfonamide
CID 45273120

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide (CID 110402158) is 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide is O=S(=O)(Nc1oncc1-c1ccccc1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide?
The InChIKey is QVCNXDXGLVJECD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN2O3S2/c14-11-6-7-12(20-11)21(17,18)16-13-10(8-15-19-13)9-4-2-1-3-5-9/h1-8,16H.
What are the key properties of 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide?
5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide has a molecular weight of 340.81 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-phenyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 110402158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).