G317-0132 Screening compound: 4-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]benzonitrile

G317-0132 Screening compound: 4-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]benzonitrile
G317-0132 Screening compound: 4-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound G317-0132
4-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]benzonitrile

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

G317-0132

Molecular Formula

C13H10N2O3 (C13 H10 N2 O3)

Compound Name

4-[(2-ethoxy-3,4-dioxocyclobut-1-en-1-yl)amino]benzonitrile

IUPAC name

n/a

SMILES

CCOC(C(C1=O)=O)=C1Nc(cc1)ccc1C#N

InChI

InChI=1S/C13H10N2O3/c1-2-18-13-10(11(16)12(13)17)15-9-5-3-8(7-14)4-6-9/h3-6,15H,2H2,1H3

InChI Key

UFRUQPGNYQRKLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14997366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

242.23

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.717

Distribution Coefficient, logD

1.484

Water Solubility, LogSw

-2.41

Polar Surface Area

60.664

Acid Dissociation Constant (pKa)

7.55

Base Dissociation Constant (pKb)

-2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with G317-0132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G317-0132?
Check Price and Availability of G317-0132, 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 G317-0132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G317-0132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G317-0132
  • 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 G317-0132 available by request