G764-0649 Screening compound: methyl 2-[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]propanoate

G764-0649 Screening compound: methyl 2-[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]propanoate
G764-0649 Screening compound: methyl 2-[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G764-0649
methyl 2-[({7'-fluoro-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl}carbonyl)amino]propanoate

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

G764-0649

Molecular Formula

C20H23FN4O3 (C20 H23 FN4 O3)

Compound Name

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

IUPAC name

methyl 2-[({7'-fluoro-5'H-spiro[piperidine-44'-pyrrolo[12-a]quinoxalin]-1-yl}carbonyl)amino]propanoate

SMILES

CC(C(OC)=O)NC(N(CC1)CCC11Nc(cc(cc2)F)c2-n2c1ccc2)=O

InChI

InChI=1S/C20H23FN4O3/c1-13(18(26)28-2)22-19(27)24-10-7-20(8-11-24)17-4-3-9-25(17)16-6-5-14(21)12-15(16)23-20/h3-6,9,12-13,23H,7-8,10-11H2,1-2H3,(H,22,27)/t13-/m0/s1

InChI Key

CPTMOLUHWQAXBY-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD15034179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.084

Distribution Coefficient, logD

3.084

Water Solubility, LogSw

-3.46

Polar Surface Area

61.146

Acid Dissociation Constant (pKa)

15.28

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

G764-0649 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G764-0649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G764-0649?
Check Price and Availability of G764-0649, 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 G764-0649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G764-0649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G764-0649
  • 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 G764-0649 available by request