8020-1498 Screening compound: 5-(4-fluorobenzoyl)-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione

8020-1498 Screening compound: 5-(4-fluorobenzoyl)-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione
8020-1498 Screening compound: 5-(4-fluorobenzoyl)-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1498
5-(4-fluorobenzoyl)-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione

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

8020-1498

Molecular Formula

C14H13FN2O3 (C14 H13 FN2 O3)

Compound Name

5-(4-fluorobenzoyl)-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione

IUPAC name

5-(4-fluorobenzoyl)-136-trimethyl-1234-tetrahydropyrimidine-24-dione

SMILES

CC(N(C)C(N1C)=O)=C(C(c(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C14H13FN2O3/c1-8-11(13(19)17(3)14(20)16(8)2)12(18)9-4-6-10(15)7-5-9/h4-7H,1-3H3

InChI Key

FWIMVUFNQUIMHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12031117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.730

Distribution Coefficient, logD

1.730

Water Solubility, LogSw

-2.07

Polar Surface Area

45.309

Acid Dissociation Constant (pKa)

28.20

Base Dissociation Constant (pKb)

-5.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.43

References: we are preparing a list of scientific research reports with 8020-1498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1498?
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What is the minimum amount of 8020-1498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1498
  • 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 8020-1498 available by request