D479-0234 Screening compound: methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate

D479-0234 Screening compound: methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate
D479-0234 Screening compound: methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D479-0234
methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-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

D479-0234

Molecular Formula

C10H10N2O3 (C10 H10 N2 O3)

Compound Name

methyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate

IUPAC name

methyl 3-oxo-1234-tetrahydroquinoxaline-1-carboxylate

SMILES

COC(N(C1)c(cccc2)c2NC1=O)=O

InChI

InChI=1S/C10H10N2O3/c1-15-10(14)12-6-9(13)11-7-4-2-3-5-8(7)12/h2-5H,6H2,1H3,(H,11,13)

InChI Key

GISJEPZLCQMWCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12961830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

206.2

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.947

Distribution Coefficient, logD

0.947

Water Solubility, LogSw

-2.13

Polar Surface Area

47.129

Acid Dissociation Constant (pKa)

11.23

Base Dissociation Constant (pKb)

-1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D479-0234 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with D479-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D479-0234?
Check Price and Availability of D479-0234, 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 D479-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D479-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D479-0234
  • 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 D479-0234 available by request