G797-0339 Screening compound: methyl 2-[(4-{pyrrolo[1,2-a]quinoxalin-4-yl}-1,4-diazepane-1-carbonyl)amino]acetate

G797-0339 Screening compound: methyl 2-[(4-{pyrrolo[1,2-a]quinoxalin-4-yl}-1,4-diazepane-1-carbonyl)amino]acetate
G797-0339 Screening compound: methyl 2-[(4-{pyrrolo[1,2-a]quinoxalin-4-yl}-1,4-diazepane-1-carbonyl)amino]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G797-0339
methyl 2-[(4-{pyrrolo[1,2-a]quinoxalin-4-yl}-1,4-diazepane-1-carbonyl)amino]acetate

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

G797-0339

Molecular Formula

C20H23N5O3 (C20 H23 N5 O3)

Compound Name

methyl 2-[(4-{pyrrolo[1,2-a]quinoxalin-4-yl}-1,4-diazepane-1-carbonyl)amino]acetate

IUPAC name

methyl 2-[(4-{pyrrolo[12-a]quinoxalin-4-yl}-14-diazepane-1-carbonyl)amino]acetate

SMILES

COC(CNC(N(CCC1)CCN1c1nc(cccc2)c2n2c1ccc2)=O)=O

InChI

InChI=1S/C20H23N5O3/c1-28-18(26)14-21-20(27)24-10-5-9-23(12-13-24)19-17-8-4-11-25(17)16-7-3-2-6-15(16)22-19/h2-4,6-8,11H,5,9-10,12-14H2,1H3,(H,21,27)

InChI Key

LLTSRKLVGFIVQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27160036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.454

Distribution Coefficient, logD

1.946

Water Solubility, LogSw

-2.61

Polar Surface Area

58.939

Acid Dissociation Constant (pKa)

15.30

Base Dissociation Constant (pKb)

12.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

G797-0339 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G797-0339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G797-0339?
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What is the minimum amount of G797-0339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G797-0339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G797-0339
  • 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 G797-0339 available by request