G797-0368 Screening compound: 4-{7-bromopyrrolo[1,2-a]quinoxalin-4-yl}-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide

G797-0368 Screening compound: 4-{7-bromopyrrolo[1,2-a]quinoxalin-4-yl}-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide
G797-0368 Screening compound: 4-{7-bromopyrrolo[1,2-a]quinoxalin-4-yl}-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G797-0368
4-{7-bromopyrrolo[1,2-a]quinoxalin-4-yl}-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide

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

G797-0368

Molecular Formula

C25H26BrN5O2 (C25 H26 BrN5 O2)

Compound Name

4-{7-bromopyrrolo[1,2-a]quinoxalin-4-yl}-N-(4-ethoxyphenyl)-1,4-diazepane-1-carboxamide

IUPAC name

4-{7-bromopyrrolo[12-a]quinoxalin-4-yl}-N-(4-ethoxyphenyl)-14-diazepane-1-carboxamide

SMILES

CCOc(cc1)ccc1NC(N(CCC1)CCN1c1nc(cc(cc2)Br)c2n2c1ccc2)=O

InChI

InChI=1S/C25H26BrN5O2/c1-2-33-20-9-7-19(8-10-20)27-25(32)30-13-4-12-29(15-16-30)24-23-5-3-14-31(23)22-11-6-18(26)17-21(22)28-24/h3,5-11,14,17H,2,4,12-13,15-16H2,1H3,(H,27,32)

InChI Key

JILKUVXIMNJUIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27160063

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.712

Distribution Coefficient, logD

5.629

Water Solubility, LogSw

-5.34

Polar Surface Area

43.890

Acid Dissociation Constant (pKa)

13.70

Base Dissociation Constant (pKb)

6.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

G797-0368 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G797-0368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G797-0368?
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What is the minimum amount of G797-0368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G797-0368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G797-0368
  • 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 G797-0368 available by request