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

C14H12N2O4S2 — CID 51048851

IUPACN-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(-c2ccno2)cs1
InChIInChI=1S/C14H12N2O4S2/c1-19-13-5-3-2-4-11(13)16-22(17,18)14-8-10(9-21-14)12-6-7-15-20-12/h2-9,16H,1H3
InChIKeyYMPHEXKEWHKAFN-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.21
Rot. Bonds5

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

N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide (PubChem CID 51048851) has the molecular formula C14H12N2O4S2 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
PubChem CID51048851
Molecular FormulaC14H12N2O4S2
Molecular Weight336.39 g/mol
Exact Mass336.02
IUPAC NameN-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(-c2ccno2)cs1
InChIInChI=1S/C14H12N2O4S2/c1-19-13-5-3-2-4-11(13)16-22(17,18)14-8-10(9-21-14)12-6-7-15-20-12/h2-9,16H,1H3
InChIKeyYMPHEXKEWHKAFN-UHFFFAOYSA-N
XLogP3.21
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyphenyl)-5-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 53112015
N-(3-chlorophenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 51043927
4-(1,2-oxazol-5-yl)-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide
CID 46393001
2-methoxy-N-(2-methylphenyl)-4-(1,2-oxazol-5-yl)benzenesulfonamide
CID 53094896
N-(3-ethoxypropyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 46393004
N-(2-methoxy-5-methylphenyl)-4-(1H-pyrazol-5-yl)thiophene-2-sulfonamide
CID 53130905
N-(5-chloro-2-methoxyphenyl)-4-(2-methylpyrazol-3-yl)thiophene-2-sulfonamide
CID 53130934
N-(2-chloro-4-fluorophenyl)-2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonamide
CID 53094934
N-(2-methoxyphenyl)-2-methyl-4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 53095046
4,6-dimethoxy-1-N,3-N-bis(2-methoxyphenyl)benzene-1,3-disulfonamide
CID 17349147
5-(5-piperidin-1-ylsulfonylthiophen-3-yl)-1,2-oxazole
CID 51048399
N-(5-chloro-2,4-dimethoxyphenyl)-2-methoxy-4-(1,2-oxazol-5-yl)benzenesulfonamide
CID 53094864

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide (CID 51048851) is N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide is COc1ccccc1NS(=O)(=O)c1cc(-c2ccno2)cs1.
What is the InChIKey of N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide?
The InChIKey is YMPHEXKEWHKAFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4S2/c1-19-13-5-3-2-4-11(13)16-22(17,18)14-8-10(9-21-14)12-6-7-15-20-12/h2-9,16H,1H3.
What are the key properties of N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide?
N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide has a molecular weight of 336.39 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4-(1,2-oxazol-5-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 51048851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).