1473-0338 Screening compound: 2-(3-nitrophenyl)-2-oxoethyl 2-benzenesulfonamidoacetate

1473-0338 Screening compound: 2-(3-nitrophenyl)-2-oxoethyl 2-benzenesulfonamidoacetate
1473-0338 Screening compound: 2-(3-nitrophenyl)-2-oxoethyl 2-benzenesulfonamidoacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1473-0338
2-(3-nitrophenyl)-2-oxoethyl 2-benzenesulfonamidoacetate

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

1473-0338

Molecular Formula

C16H14N2O7S (C16 H14 N2 O7 S)

Compound Name

2-(3-nitrophenyl)-2-oxoethyl 2-benzenesulfonamidoacetate

IUPAC name

2-(3-nitrophenyl)-2-oxoethyl 2-benzenesulfonamidoacetate

SMILES

[O-][N+](c1cccc(C(COC(CNS(c2ccccc2)(=O)=O)=O)=O)c1)=O

InChI

InChI=1S/C16H14N2O7S/c19-15(12-5-4-6-13(9-12)18(21)22)11-25-16(20)10-17-26(23,24)14-7-2-1-3-8-14/h1-9,17H,10-11H2

InChI Key

YGKDQADOLULHGR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00761596

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.36

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.194

Distribution Coefficient, logD

2.193

Water Solubility, LogSw

-2.94

Polar Surface Area

109.159

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

-7.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

1473-0338 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1473-0338 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1473-0338?
Check Price and Availability of 1473-0338, 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 1473-0338 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1473-0338
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1473-0338
  • 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 1473-0338 available by request