CAS 343372-72-5 | N-{[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl}benzenesulfonamide | CAS Number 343372-72-5

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343372-72-5 | N-{[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl}benzenesulfonamide

CAS No: 343372-72-5 Catalog No: AG00IUV2 MDL No:MFCD01315716

Product Description

Catalog Number:

AG00IUV2

Chemical Name:

N-{[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl}benzenesulfonamide

CAS Number:

343372-72-5

Molecular Formula:

C17H16N2O4S

Molecular Weight:

344.3849

MDL Number:

MFCD01315716

IUPAC Name:

N-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl]benzenesulfonamide

InChI:

InChI=1S/C17H16N2O4S/c1-22-14-9-7-13(8-10-14)17-11-15(23-19-17)12-18-24(20,21)16-5-3-2-4-6-16/h2-11,18H,12H2,1H3

InChI Key:

GHLQJCUCOQSQFJ-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)c1noc(c1)CNS(=O)(=O)c1ccccc1

Properties

Complexity:

479

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

344.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

344.385g/mol

Monoisotopic Mass:

344.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

89.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
Characterization of type II ligands in CYP2C9 and CYP3A4.	Journal of medicinal chemistry 20080327
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501