G764-0643 Screening compound: ethyl 4-{[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]methyl}cyclohexane-1-carboxylate

G764-0643 Screening compound: ethyl 4-{[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]methyl}cyclohexane-1-carboxylate
G764-0643 Screening compound: ethyl 4-{[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]methyl}cyclohexane-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G764-0643
ethyl 4-{[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]methyl}cyclohexane-1-carboxylate

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

G764-0643

Molecular Formula

C26H33FN4O3 (C26 H33 FN4 O3)

Compound Name

ethyl 4-{[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]methyl}cyclohexane-1-carboxylate

IUPAC name

ethyl 4-{[({7'-fluoro-5'H-spiro[piperidine-44'-pyrrolo[12-a]quinoxalin]-1-yl}carbonyl)amino]methyl}cyclohexane-1-carboxylate

SMILES

CCOC(C1CCC(CNC(N(CC2)CCC22Nc(cc(cc3)F)c3-n3c2ccc3)=O)CC1)=O

InChI

InChI=1S/C26H33FN4O3/c1-2-34-24(32)19-7-5-18(6-8-19)17-28-25(33)30-14-11-26(12-15-30)23-4-3-13-31(23)22-10-9-20(27)16-21(22)29-26/h3-4,9-10,13,16,18-19,29H,2,5-8,11-12,14-15,17H2,1H3,(H,28,33)

InChI Key

LJQRBQYSRXZVFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15034173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.818

Distribution Coefficient, logD

4.818

Water Solubility, LogSw

-4.48

Polar Surface Area

61.483

Acid Dissociation Constant (pKa)

16.10

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

G764-0643 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G764-0643 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G764-0643?
Check Price and Availability of G764-0643, 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 G764-0643 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G764-0643
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G764-0643
  • 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 G764-0643 available by request