C202-4126 Screening compound: 6-hydroxy-5-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

C202-4126 Screening compound: 6-hydroxy-5-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
C202-4126 Screening compound: 6-hydroxy-5-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-4126
6-hydroxy-5-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

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

C202-4126

Molecular Formula

C14H12N2O5 (C14 H12 N2 O5)

Compound Name

6-hydroxy-5-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

6-hydroxy-5-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-1234-tetrahydropyrimidine-24-dione

SMILES

COc1ccc(/C=C/C(C(C(NC(N2)=O)=O)=C2O)=O)cc1

InChI

InChI=1S/C14H12N2O5/c1-21-9-5-2-8(3-6-9)4-7-10(17)11-12(18)15-14(20)16-13(11)19/h2-7H,1H3,(H3,15,16,18,19,20)

InChI Key

LKNROJMSZRQDJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12827670

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.26

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.765

Distribution Coefficient, logD

-5.731

Water Solubility, LogSw

-1.77

Polar Surface Area

85.811

Acid Dissociation Constant (pKa)

0.90

Base Dissociation Constant (pKb)

-6.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

C202-4126 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C202-4126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-4126?
Check Price and Availability of C202-4126, 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 C202-4126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-4126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-4126
  • 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 C202-4126 available by request