0960-0284 Screening compound: (1E,2E)-N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-(4-nitrophenyl)prop-2-en-1-imine

0960-0284 Screening compound: (1E,2E)-N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-(4-nitrophenyl)prop-2-en-1-imine
0960-0284 Screening compound: (1E,2E)-N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-(4-nitrophenyl)prop-2-en-1-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0960-0284
(1E,2E)-N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-(4-nitrophenyl)prop-2-en-1-imine

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

0960-0284

Molecular Formula

C22H14BrN3O3 (C22 H14 BrN3 O3)

Compound Name

(1E,2E)-N-[2-(2-bromophenyl)-1,3-benzoxazol-5-yl]-3-(4-nitrophenyl)prop-2-en-1-imine

IUPAC name

(1E2E)-N-[2-(2-bromophenyl)-13-benzoxazol-5-yl]-3-(4-nitrophenyl)prop-2-en-1-imine

SMILES

[O-][N+](c1ccc(/C=C/C=N/c(cc2)cc3c2oc(-c(cccc2)c2Br)n3)cc1)=O

InChI

InChI=1S/C22H14BrN3O3/c23-19-6-2-1-5-18(19)22-25-20-14-16(9-12-21(20)29-22)24-13-3-4-15-7-10-17(11-8-15)26(27)28/h1-14H

InChI Key

KJUFOAQBWVFGPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00657255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.28

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.450

Distribution Coefficient, logD

5.450

Water Solubility, LogSw

-5.94

Polar Surface Area

59.189

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0960-0284 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Frequent Hitters Library (7624 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0960-0284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0960-0284?
Check Price and Availability of 0960-0284, 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 0960-0284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0960-0284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0960-0284
  • 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 0960-0284 available by request