G673-0002 Screening compound: ethyl 1-{2-[3-(dimethylcarbamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetyl}piperidine-4-carboxylate

G673-0002 Screening compound: ethyl 1-{2-[3-(dimethylcarbamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetyl}piperidine-4-carboxylate
G673-0002 Screening compound: ethyl 1-{2-[3-(dimethylcarbamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetyl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G673-0002
ethyl 1-{2-[3-(dimethylcarbamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetyl}piperidine-4-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

G673-0002

Molecular Formula

C25H34N4O5 (C25 H34 N4 O5)

Compound Name

ethyl 1-{2-[3-(dimethylcarbamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetyl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{2-[3-(dimethylcarbamoyl)-6-oxo-5H6H6aH7H8H9H10H-pyrido[12-a]quinoxalin-5-yl]acetyl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(CN1c(cc(cc2)C(N(C)C)=O)c2N(CCCC2)C2C1=O)=O)=O

InChI

InChI=1S/C25H34N4O5/c1-4-34-25(33)17-10-13-27(14-11-17)22(30)16-29-21-15-18(23(31)26(2)3)8-9-19(21)28-12-6-5-7-20(28)24(29)32/h8-9,15,17,20H,4-7,10-14,16H2,1-3H3

InChI Key

MDXLHEZJHVSBKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15028271

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.415

Distribution Coefficient, logD

0.415

Water Solubility, LogSw

-1.77

Polar Surface Area

70.939

Acid Dissociation Constant (pKa)

15.09

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

G673-0002 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

CNS MPO Library (28609 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with G673-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G673-0002?
Check Price and Availability of G673-0002, 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 G673-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G673-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G673-0002
  • 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 G673-0002 available by request