8019-9031 Screening compound: 5-benzoyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

8019-9031 Screening compound: 5-benzoyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
8019-9031 Screening compound: 5-benzoyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-9031
5-benzoyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-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

8019-9031

Molecular Formula

C22H20N2O5 (C22 H20 N2 O5)

Compound Name

5-benzoyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

5-benzoyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]-13-dimethyl-1234-tetrahydropyrimidine-24-dione

SMILES

CN(C(CC(c(cc1)ccc1OC)=O)=C(C(c1ccccc1)=O)C(N1C)=O)C1=O

InChI

InChI=1S/C22H20N2O5/c1-23-17(13-18(25)14-9-11-16(29-3)12-10-14)19(21(27)24(2)22(23)28)20(26)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3

InChI Key

GKXYCNSQKDHGSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12034117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.578

Distribution Coefficient, logD

2.578

Water Solubility, LogSw

-2.69

Polar Surface Area

66.190

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

-7.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

8019-9031 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8019-9031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-9031?
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What is the minimum amount of 8019-9031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-9031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-9031
  • 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 8019-9031 available by request