0917-0260 Screening compound: 2-(4-CHLORO-3-NITROPHENYL)-4H-3,1-BENZOXAZIN-4-ONE

0917-0260 Screening compound: 2-(4-CHLORO-3-NITROPHENYL)-4H-3,1-BENZOXAZIN-4-ONE
0917-0260 Screening compound: 2-(4-CHLORO-3-NITROPHENYL)-4H-3,1-BENZOXAZIN-4-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 0917-0260
2-(4-CHLORO-3-NITROPHENYL)-4H-3,1-BENZOXAZIN-4-ONE

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

0917-0260

Molecular Formula

C14H7ClN2O4 (C14 H7 ClN2 O4)

Compound Name

2-(4-CHLORO-3-NITROPHENYL)-4H-3,1-BENZOXAZIN-4-ONE

IUPAC name

n/a

SMILES

[O-][N+](c(cc(cc1)C(O2)=Nc(cccc3)c3C2=O)c1Cl)=O

InChI

InChI=1S/C14H7ClN2O4/c15-10-6-5-8(7-12(10)17(19)20)13-16-11-4-2-1-3-9(11)14(18)21-13/h1-7H

InChI Key

ZYMZJDWJYQZCOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00087135

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.67

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.876

Distribution Coefficient, logD

2.876

Water Solubility, LogSw

-3.97

Polar Surface Area

63.266

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0917-0260 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 0917-0260 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0917-0260?
Check Price and Availability of 0917-0260, 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 0917-0260 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0917-0260
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0917-0260
  • 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 0917-0260 available by request