C517-5426 Screening compound: N-(2,2-diethoxyethyl)-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

C517-5426 Screening compound: N-(2,2-diethoxyethyl)-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
C517-5426 Screening compound: N-(2,2-diethoxyethyl)-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C517-5426
N-(2,2-diethoxyethyl)-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C517-5426

Molecular Formula

C14H20N2O6S (C14 H20 N2 O6 S)

Compound Name

N-(2,2-diethoxyethyl)-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

IUPAC name

N-(22-diethoxyethyl)-3-methyl-2-oxo-23-dihydro-13-benzoxazole-6-sulfonamide

SMILES

CCOC(CNS(c(cc1)cc(O2)c1N(C)C2=O)(=O)=O)OCC

InChI

InChI=1S/C14H20N2O6S/c1-4-20-13(21-5-2)9-15-23(18,19)10-6-7-11-12(8-10)22-14(17)16(11)3/h6-8,13,15H,4-5,9H2,1-3H3

InChI Key

BMSYYRIOJPBRQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14764167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.39

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.050

Distribution Coefficient, logD

1.050

Water Solubility, LogSw

-2.50

Polar Surface Area

79.788

Acid Dissociation Constant (pKa)

11.42

Base Dissociation Constant (pKb)

-4.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with C517-5426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C517-5426?
Check Price and Availability of C517-5426, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C517-5426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C517-5426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C517-5426
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C517-5426 available by request