C201-0423 Screening compound: ethyl 3-[1-(quinoxalin-2-yl)piperidine-3-amido]benzoate

C201-0423 Screening compound: ethyl 3-[1-(quinoxalin-2-yl)piperidine-3-amido]benzoate
C201-0423 Screening compound: ethyl 3-[1-(quinoxalin-2-yl)piperidine-3-amido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0423
ethyl 3-[1-(quinoxalin-2-yl)piperidine-3-amido]benzoate

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

C201-0423

Molecular Formula

C23H24N4O3 (C23 H24 N4 O3)

Compound Name

ethyl 3-[1-(quinoxalin-2-yl)piperidine-3-amido]benzoate

IUPAC name

ethyl 3-[1-(quinoxalin-2-yl)piperidine-3-amido]benzoate

SMILES

CCOC(c1cc(NC(C(CCC2)CN2c2nc3ccccc3nc2)=O)ccc1)=O

InChI

InChI=1S/C23H24N4O3/c1-2-30-23(29)16-7-5-9-18(13-16)25-22(28)17-8-6-12-27(15-17)21-14-24-19-10-3-4-11-20(19)26-21/h3-5,7,9-11,13-14,17H,2,6,8,12,15H2,1H3,(H,25,28)/t17-/m0/s1

InChI Key

FKJRQRGZAUXJJN-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD09248511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.426

Distribution Coefficient, logD

4.426

Water Solubility, LogSw

-4.09

Polar Surface Area

64.387

Acid Dissociation Constant (pKa)

11.30

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

C201-0423 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C201-0423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0423?
Check Price and Availability of C201-0423, 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 C201-0423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0423
  • 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 C201-0423 available by request