C700-2496 Screening compound: [4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazino](1H-indol-2-yl)methanone

C700-2496 Screening compound: [4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazino](1H-indol-2-yl)methanone
C700-2496 Screening compound: [4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazino](1H-indol-2-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2496
[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazino](1H-indol-2-yl)methanone

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

C700-2496

Molecular Formula

C24H20BrN5O (C24 H20 BrN5 O)

Compound Name

[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazino](1H-indol-2-yl)methanone

IUPAC name

2-(4-{7-bromopyrrolo[12-a]quinoxalin-4-yl}piperazine-1-carbonyl)-1H-indole

SMILES

O=C(c1cc(cccc2)c2[nH]1)N(CC1)CCN1c1nc(cc(cc2)Br)c2n2c1ccc2

InChI

InChI=1S/C24H20BrN5O/c25-17-7-8-21-19(15-17)27-23(22-6-3-9-30(21)22)28-10-12-29(13-11-28)24(31)20-14-16-4-1-2-5-18(16)26-20/h1-9,14-15,26H,10-13H2

InChI Key

UWKYPKZHHZJCHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27641743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.708

Distribution Coefficient, logD

5.698

Water Solubility, LogSw

-6.45

Polar Surface Area

36.964

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

C700-2496 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C700-2496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2496?
Check Price and Availability of C700-2496, 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 C700-2496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2496
  • 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 C700-2496 available by request