Y010-0029 Screening compound: 1-(2,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione

Y010-0029 Screening compound: 1-(2,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Y010-0029 Screening compound: 1-(2,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-0029
1-(2,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione

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

Y010-0029

Molecular Formula

C12H12N2O3 (C12 H12 N2 O3)

Compound Name

1-(2,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione

IUPAC name

1-(24-dimethylphenyl)-13-diazinane-246-trione

SMILES

Cc(cc1)cc(C)c1N(C(CC(N1)=O)=O)C1=O

InChI

InChI=1S/C12H12N2O3/c1-7-3-4-9(8(2)5-7)14-11(16)6-10(15)13-12(14)17/h3-5H,6H2,1-2H3,(H,13,15,17)

InChI Key

ACDUXFLNNGLJKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07375427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

232.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.149

Distribution Coefficient, logD

-3.624

Water Solubility, LogSw

-2.14

Polar Surface Area

53.582

Acid Dissociation Constant (pKa)

2.63

Base Dissociation Constant (pKb)

-5.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y010-0029 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

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

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y010-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-0029?
Check Price and Availability of Y010-0029, 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 Y010-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-0029
  • 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 Y010-0029 available by request