G797-0745 Screening compound: 4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N~1~-(tetrahydro-2-furanylmethyl)tetrahydro-1(2H)-pyrazinecarboxamide

G797-0745 Screening compound: 4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N~1~-(tetrahydro-2-furanylmethyl)tetrahydro-1(2H)-pyrazinecarboxamide
G797-0745 Screening compound: 4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N~1~-(tetrahydro-2-furanylmethyl)tetrahydro-1(2H)-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G797-0745
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N~1~-(tetrahydro-2-furanylmethyl)tetrahydro-1(2H)-pyrazinecarboxamide

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

G797-0745

Molecular Formula

C21H24BrN5O2 (C21 H24 BrN5 O2)

Compound Name

4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N~1~-(tetrahydro-2-furanylmethyl)tetrahydro-1(2H)-pyrazinecarboxamide

IUPAC name

4-{7-bromopyrrolo[12-a]quinoxalin-4-yl}-N-[(oxolan-2-yl)methyl]piperazine-1-carboxamide

SMILES

O=C(NCC1OCCC1)N(CC1)CCN1c1nc(cc(cc2)Br)c2n2c1ccc2

InChI

InChI=1S/C21H24BrN5O2/c22-15-5-6-18-17(13-15)24-20(19-4-1-7-27(18)19)25-8-10-26(11-9-25)21(28)23-14-16-3-2-12-29-16/h1,4-7,13,16H,2-3,8-12,14H2,(H,23,28)/t16-/m1/s1

InChI Key

JNXLJBUYDMYIBE-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD27160204

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.447

Distribution Coefficient, logD

3.431

Water Solubility, LogSw

-3.54

Polar Surface Area

46.412

Acid Dissociation Constant (pKa)

15.70

Base Dissociation Constant (pKb)

10.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

G797-0745 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G797-0745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G797-0745?
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What is the minimum amount of G797-0745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G797-0745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G797-0745
  • 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 G797-0745 available by request