C301-8233 Screening compound: 1,3-dimethyl 5-(3-chloroquinoxaline-2-amido)benzene-1,3-dicarboxylate

C301-8233 Screening compound: 1,3-dimethyl 5-(3-chloroquinoxaline-2-amido)benzene-1,3-dicarboxylate
C301-8233 Screening compound: 1,3-dimethyl 5-(3-chloroquinoxaline-2-amido)benzene-1,3-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-8233
1,3-dimethyl 5-(3-chloroquinoxaline-2-amido)benzene-1,3-dicarboxylate

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

C301-8233

Molecular Formula

C19H14ClN3O5 (C19 H14 ClN3 O5)

Compound Name

1,3-dimethyl 5-(3-chloroquinoxaline-2-amido)benzene-1,3-dicarboxylate

IUPAC name

13-dimethyl 5-(3-chloroquinoxaline-2-amido)benzene-13-dicarboxylate

SMILES

COC(c1cc(NC(c2nc3ccccc3nc2Cl)=O)cc(C(OC)=O)c1)=O

InChI

InChI=1S/C19H14ClN3O5/c1-27-18(25)10-7-11(19(26)28-2)9-12(8-10)21-17(24)15-16(20)23-14-6-4-3-5-13(14)22-15/h3-9H,1-2H3,(H,21,24)

InChI Key

OELQSJCBKMGTLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14745316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.79

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.060

Distribution Coefficient, logD

4.039

Water Solubility, LogSw

-4.43

Polar Surface Area

84.018

Acid Dissociation Constant (pKa)

8.70

Base Dissociation Constant (pKb)

-3.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

C301-8233 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C301-8233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-8233?
Check Price and Availability of C301-8233, 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 C301-8233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-8233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-8233
  • 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 C301-8233 available by request