4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide

C17H18N2O3S2 — CID 46393030

IUPAC4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide
SMILESCCc1ccc(NS(=O)(=O)c2cc(-c3cc(CC)no3)cs2)cc1
InChIInChI=1S/C17H18N2O3S2/c1-3-12-5-7-15(8-6-12)19-24(20,21)17-9-13(11-23-17)16-10-14(4-2)18-22-16/h5-11,19H,3-4H2,1-2H3
InChIKeyWRIZWNQHQKCNLH-UHFFFAOYSA-N
MW362.48 g/mol
LogP4.33
Rot. Bonds6

About 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide

4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide (PubChem CID 46393030) has the molecular formula C17H18N2O3S2 and a molecular weight of 362.48 g/mol. Its IUPAC name is 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide
PubChem CID46393030
Molecular FormulaC17H18N2O3S2
Molecular Weight362.48 g/mol
Exact Mass362.08
IUPAC Name4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide
SMILESCCc1ccc(NS(=O)(=O)c2cc(-c3cc(CC)no3)cs2)cc1
InChIInChI=1S/C17H18N2O3S2/c1-3-12-5-7-15(8-6-12)19-24(20,21)17-9-13(11-23-17)16-10-14(4-2)18-22-16/h5-11,19H,3-4H2,1-2H3
InChIKeyWRIZWNQHQKCNLH-UHFFFAOYSA-N
XLogP4.33
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-[[4-(3-ethyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonylamino]benzoate
CID 50835221
N-benzyl-4-(3-ethyl-1,2-oxazol-5-yl)-N-propan-2-ylthiophene-2-sulfonamide
CID 50835263
4-(3-ethyl-1,2-oxazol-5-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]thiophene-2-sulfonamide
CID 50835113
2-ethyl-N-(4-ethylphenyl)-5-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamide
CID 20936343
N-(3-ethylphenyl)-4-(5-methyl-1,2,4-oxadiazol-3-yl)thiophene-2-sulfonamide
CID 46380254
N-(3-bromophenyl)-4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 50835152
N-(2-ethylphenyl)-4-(4-ethyl-1,3-thiazol-2-yl)thiophene-2-sulfonamide
CID 53133547
4-(1,2-oxazol-5-yl)-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide
CID 46393001
4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-N-(4-methylphenyl)thiophene-2-sulfonamide
CID 53042877
N-(3-chlorophenyl)-4-(5-ethyl-1,3,4-oxadiazol-2-yl)thiophene-2-sulfonamide
CID 53127273
4-(3-methyl-1,2-oxazol-5-yl)-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-2-sulfonamide
CID 46393018
N-[(4-ethylphenyl)methyl]-4-(1-methyl-6-oxopyridazin-3-yl)thiophene-2-sulfonamide
CID 53135094

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide?
The IUPAC name of 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide (CID 46393030) is 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide is CCc1ccc(NS(=O)(=O)c2cc(-c3cc(CC)no3)cs2)cc1.
What is the InChIKey of 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide?
The InChIKey is WRIZWNQHQKCNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S2/c1-3-12-5-7-15(8-6-12)19-24(20,21)17-9-13(11-23-17)16-10-14(4-2)18-22-16/h5-11,19H,3-4H2,1-2H3.
What are the key properties of 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide?
4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide has a molecular weight of 362.48 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethyl-1,2-oxazol-5-yl)-N-(4-ethylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 46393030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).