0924-0050 Screening compound: 5-(4-bromobenzyl)-5H-benzo[g]indolo[2,3-b]quinoxaline

0924-0050 Screening compound: 5-(4-bromobenzyl)-5H-benzo[g]indolo[2,3-b]quinoxaline
0924-0050 Screening compound: 5-(4-bromobenzyl)-5H-benzo[g]indolo[2,3-b]quinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound 0924-0050
5-(4-bromobenzyl)-5H-benzo[g]indolo[2,3-b]quinoxaline

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

0924-0050

Molecular Formula

C25H16BrN3 (C25 H16 BrN3)

Compound Name

5-(4-bromobenzyl)-5H-benzo[g]indolo[2,3-b]quinoxaline

IUPAC name

10-[(4-bromophenyl)methyl]-21012-triazapentacyclo[11.8.0.0^{311}.0^{49}.0^{1520}]henicosa-1(13)24(9)571114161820-decaene

SMILES

Brc1ccc(Cn2c3nc4cc5ccccc5cc4nc3c3c2cccc3)cc1

InChI

InChI=1S/C25H16BrN3/c26-19-11-9-16(10-12-19)15-29-23-8-4-3-7-20(23)24-25(29)28-22-14-18-6-2-1-5-17(18)13-21(22)27-24/h1-14H,15H2

InChI Key

PHPKFRADFWVAMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00993222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.33

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.427

Distribution Coefficient, logD

7.426

Water Solubility, LogSw

-7.44

Polar Surface Area

19.219

Acid Dissociation Constant (pKa)

24.20

Base Dissociation Constant (pKb)

4.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

0924-0050 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0924-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0924-0050?
Check Price and Availability of 0924-0050, 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 0924-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0924-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0924-0050
  • 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 0924-0050 available by request