C700-2249 Screening compound: 4-{7-bromo-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}-N-[2-(3-methoxyphenyl)ethyl]butanamide

C700-2249 Screening compound: 4-{7-bromo-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}-N-[2-(3-methoxyphenyl)ethyl]butanamide
C700-2249 Screening compound: 4-{7-bromo-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}-N-[2-(3-methoxyphenyl)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2249
4-{7-bromo-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}-N-[2-(3-methoxyphenyl)ethyl]butanamide

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

C700-2249

Molecular Formula

C24H24BrN3O3 (C24 H24 BrN3 O3)

Compound Name

4-{7-bromo-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}-N-[2-(3-methoxyphenyl)ethyl]butanamide

IUPAC name

4-{7-bromo-4-oxo-4H5H-pyrrolo[12-a]quinoxalin-5-yl}-N-[2-(3-methoxyphenyl)ethyl]butanamide

SMILES

COc1cccc(CCNC(CCCN(c(cc(cc2)Br)c2-n2c3ccc2)C3=O)=O)c1

InChI

InChI=1S/C24H24BrN3O3/c1-31-19-6-2-5-17(15-19)11-12-26-23(29)8-4-14-28-22-16-18(25)9-10-20(22)27-13-3-7-21(27)24(28)30/h2-3,5-7,9-10,13,15-16H,4,8,11-12,14H2,1H3,(H,26,29)

InChI Key

KLIJHYVXCZMEGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14785877

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.474

Distribution Coefficient, logD

3.474

Water Solubility, LogSw

-3.80

Polar Surface Area

48.801

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C700-2249 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C700-2249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2249?
Check Price and Availability of C700-2249, 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 C700-2249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2249
  • 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 C700-2249 available by request