3257-3821 Screening compound: 1-{4-[2-nitro-4-(quinoxalin-2-yl)phenoxy]phenyl}propan-1-one

3257-3821 Screening compound: 1-{4-[2-nitro-4-(quinoxalin-2-yl)phenoxy]phenyl}propan-1-one
3257-3821 Screening compound: 1-{4-[2-nitro-4-(quinoxalin-2-yl)phenoxy]phenyl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3257-3821
1-{4-[2-nitro-4-(quinoxalin-2-yl)phenoxy]phenyl}propan-1-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

3257-3821

Molecular Formula

C23H17N3O4 (C23 H17 N3 O4)

Compound Name

1-{4-[2-nitro-4-(quinoxalin-2-yl)phenoxy]phenyl}propan-1-one

IUPAC name

1-{4-[2-nitro-4-(quinoxalin-2-yl)phenoxy]phenyl}propan-1-one

SMILES

CCC(c(cc1)ccc1Oc(ccc(-c1nc2ccccc2nc1)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C23H17N3O4/c1-2-22(27)15-7-10-17(11-8-15)30-23-12-9-16(13-21(23)26(28)29)20-14-24-18-5-3-4-6-19(18)25-20/h3-14H,2H2,1H3

InChI Key

PQYZYVXUJQDJPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02041281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.887

Distribution Coefficient, logD

4.887

Water Solubility, LogSw

-4.61

Polar Surface Area

70.583

Acid Dissociation Constant (pKa)

21.16

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

3257-3821 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 3257-3821 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3257-3821?
Check Price and Availability of 3257-3821, 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 3257-3821 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3257-3821
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3257-3821
  • 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 3257-3821 available by request