8020-2908 Screening compound: (2E)-3-(2-methylpyrimidin-5-yl)prop-2-enoic acid

8020-2908 Screening compound: (2E)-3-(2-methylpyrimidin-5-yl)prop-2-enoic acid
8020-2908 Screening compound: (2E)-3-(2-methylpyrimidin-5-yl)prop-2-enoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-2908
(2E)-3-(2-methylpyrimidin-5-yl)prop-2-enoic 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

8020-2908

Molecular Formula

C8H8N2O2 (C8 H8 N2 O2)

Compound Name

(2E)-3-(2-methylpyrimidin-5-yl)prop-2-enoic acid

IUPAC name

(2E)-3-(2-methylpyrimidin-5-yl)prop-2-enoic acid

SMILES

Cc1ncc(/C=C/C(O)=O)cn1

InChI

InChI=1S/C8H8N2O2/c1-6-9-4-7(5-10-6)2-3-8(11)12/h2-5H,1H3,(H,11,12)

InChI Key

OZHUYBOQUUSRRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11519785

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

164.16

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.449

Distribution Coefficient, logD

-1.716

Water Solubility, LogSw

-0.94

Polar Surface Area

47.850

Acid Dissociation Constant (pKa)

5.24

Base Dissociation Constant (pKb)

-1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8020-2908 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8020-2908 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-2908?
Check Price and Availability of 8020-2908, 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 8020-2908 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-2908
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-2908
  • 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 8020-2908 available by request