7808-0317 Screening compound: methyl 7-(furan-2-yl)-5-(methoxymethyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

7808-0317 Screening compound: methyl 7-(furan-2-yl)-5-(methoxymethyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
7808-0317 Screening compound: methyl 7-(furan-2-yl)-5-(methoxymethyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7808-0317
methyl 7-(furan-2-yl)-5-(methoxymethyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-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

7808-0317

Molecular Formula

C13H14N4O4 (C13 H14 N4 O4)

Compound Name

methyl 7-(furan-2-yl)-5-(methoxymethyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

IUPAC name

methyl 7-(furan-2-yl)-5-(methoxymethyl)-4H7H-[124]triazolo[15-a]pyrimidine-6-carboxylate

SMILES

COCC(Nc1ncnn1C1c2ccco2)=C1C(OC)=O

InChI

InChI=1S/C13H14N4O4/c1-19-6-8-10(12(18)20-2)11(9-4-3-5-21-9)17-13(16-8)14-7-15-17/h3-5,7,11H,6H2,1-2H3,(H,14,15,16)/t11-/m0/s1

InChI Key

JEYKYUASOQYJSV-NSHDSACASA-N

MDL Number (MFCD)

MFCD06604104

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.28

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.011

Distribution Coefficient, logD

0.520

Water Solubility, LogSw

-1.80

Polar Surface Area

76.773

Acid Dissociation Constant (pKa)

7.08

Base Dissociation Constant (pKb)

-3.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

7808-0317 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Soluble Diversity Library (15920 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 7808-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7808-0317?
Check Price and Availability of 7808-0317, 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 7808-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7808-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7808-0317
  • 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 7808-0317 available by request