D718-1058 Screening compound: 3-[6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]propanoic acid

D718-1058 Screening compound: 3-[6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]propanoic acid
D718-1058 Screening compound: 3-[6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-1058
3-[6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]propanoic acid

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

D718-1058

Molecular Formula

C11H9N5O3 (C11 H9 N5 O3)

Compound Name

3-[6-oxopyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-7(6H)-yl]propanoic acid

IUPAC name

n/a

SMILES

OC(CCN(C=Cc1c2cnc3ncnn13)C2=O)=O

InChI

InChI=1S/C11H9N5O3/c17-9(18)2-4-15-3-1-8-7(10(15)19)5-12-11-13-6-14-16(8)11/h1,3,5-6H,2,4H2,(H,17,18)

InChI Key

KKGGQYNPDPDOGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13758033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

259.22

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-1.355

Distribution Coefficient, logD

-3.887

Water Solubility, LogSw

-0.69

Polar Surface Area

80.383

Acid Dissociation Constant (pKa)

4.87

Base Dissociation Constant (pKb)

-0.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D718-1058 in Drug Discovery

Included in Screening Libraries

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D718-1058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-1058?
Check Price and Availability of D718-1058, 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 D718-1058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-1058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-1058
  • 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 D718-1058 available by request