1988-1539 Screening compound: 2,5,7-trimethylisoxazolo[2,3-a]pyrimidin-8-ium

1988-1539 Screening compound: 2,5,7-trimethylisoxazolo[2,3-a]pyrimidin-8-ium
1988-1539 Screening compound: 2,5,7-trimethylisoxazolo[2,3-a]pyrimidin-8-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-1539
2,5,7-trimethylisoxazolo[2,3-a]pyrimidin-8-ium

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

1988-1539

Molecular Formula

C9H11N2O (C9 H11 N2 O)

Compound Name

2,5,7-trimethylisoxazolo[2,3-a]pyrimidin-8-ium

IUPAC name

257-trimethyl-8lambda5-[12]oxazolo[23-a]pyrimidin-8-ylium

SMILES

Cc1cc2nc(C)cc(C)[n+]2o1

InChI

InChI=1S/C9H11N2O/c1-6-4-7(2)11-9(10-6)5-8(3)12-11/h4-5H,1-3H3/q+1

InChI Key

VVZCCKPOFNYEOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01038169

Chemical and Physical Properties

Saltdata

ClO4-

Molecular Weight

163.2

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.565

Distribution Coefficient, logD

1.565

Water Solubility, LogSw

-1.26

Polar Surface Area

16.678

Acid Dissociation Constant (pKa)

29.18

Base Dissociation Constant (pKb)

-1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

1988-1539 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1988-1539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1988-1539?
Check Price and Availability of 1988-1539, 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 1988-1539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-1539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-1539
  • 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 1988-1539 available by request