5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide

C18H15N3O5S — CID 131910108

IUPAC5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide
SMILESCc1cc(-c2ccc(S(=O)(=O)NCc3coc(-c4ccccc4)n3)o2)on1
InChIInChI=1S/C18H15N3O5S/c1-12-9-16(26-21-12)15-7-8-17(25-15)27(22,23)19-10-14-11-24-18(20-14)13-5-3-2-4-6-13/h2-9,11,19H,10H2,1H3
InChIKeyOKQXUSQECWHAIL-UHFFFAOYSA-N
MW385.40 g/mol
LogP3.38
Rot. Bonds6

About 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide

5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide (PubChem CID 131910108) has the molecular formula C18H15N3O5S and a molecular weight of 385.40 g/mol. Its IUPAC name is 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide.

Molecular Properties

Compound Name5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide
PubChem CID131910108
Molecular FormulaC18H15N3O5S
Molecular Weight385.40 g/mol
Exact Mass385.07
IUPAC Name5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide
SMILESCc1cc(-c2ccc(S(=O)(=O)NCc3coc(-c4ccccc4)n3)o2)on1
InChIInChI=1S/C18H15N3O5S/c1-12-9-16(26-21-12)15-7-8-17(25-15)27(22,23)19-10-14-11-24-18(20-14)13-5-3-2-4-6-13/h2-9,11,19H,10H2,1H3
InChIKeyOKQXUSQECWHAIL-UHFFFAOYSA-N
XLogP3.38
TPSA111.37 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.40
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide with MolForge

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Related Compounds

N-[(2S)-butan-2-yl]-5-(3-methyl-1,2-oxazol-5-yl)furan-2-sulfonamide
CID 95073598
N-[(2R)-butan-2-yl]-5-(3-methyl-1,2-oxazol-5-yl)furan-2-sulfonamide
CID 95073597
(2-phenyl-1,3-oxazol-4-yl)methyl 3-methyl-1,2-oxazole-5-carboxylate
CID 18199699
N-(3-fluorophenyl)-5-(3-methyl-1,2-oxazol-5-yl)furan-2-sulfonamide
CID 53085812
N-(3-chloro-4-methylphenyl)-5-(3-methyl-1,2-oxazol-5-yl)furan-2-sulfonamide
CID 53085828
2-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine
CID 111552687
2-methyl-1-[2-[(4-methylphenyl)sulfonylamino]ethyl]-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine
CID 111551724
1-[2-(ethylsulfonylamino)ethyl]-2-methyl-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine
CID 111552480
1-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-2-methyl-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]guanidine;hydroiodide
CID 111552483
2-ethyl-5-methyl-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]pyrazole-3-carboxamide
CID 75494256
1-[[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]methyl]-3-[(2-phenyl-1,3-oxazol-4-yl)methyl]urea
CID 100767874
5-[(2-phenyl-1,3-oxazol-4-yl)methylcarbamoyl]furan-3-carboxylic acid
CID 146132693

Frequently Asked Questions

What is the IUPAC name of 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide?
The IUPAC name of 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide (CID 131910108) is 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide.
What is the SMILES notation for 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide?
The canonical SMILES for 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide is Cc1cc(-c2ccc(S(=O)(=O)NCc3coc(-c4ccccc4)n3)o2)on1.
What is the InChIKey of 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide?
The InChIKey is OKQXUSQECWHAIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O5S/c1-12-9-16(26-21-12)15-7-8-17(25-15)27(22,23)19-10-14-11-24-18(20-14)13-5-3-2-4-6-13/h2-9,11,19H,10H2,1H3.
What are the key properties of 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide?
5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide has a molecular weight of 385.40 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methyl-1,2-oxazol-5-yl)-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]furan-2-sulfonamide is sourced from PubChem (CID 131910108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).