4510-0002 Screening compound: 1,6-diacetyl-octahydro-[1,3]diazolo[4,5-d]imidazole-2,5-dione

4510-0002 Screening compound: 1,6-diacetyl-octahydro-[1,3]diazolo[4,5-d]imidazole-2,5-dione
4510-0002 Screening compound: 1,6-diacetyl-octahydro-[1,3]diazolo[4,5-d]imidazole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4510-0002
1,6-diacetyl-octahydro-[1,3]diazolo[4,5-d]imidazole-2,5-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

4510-0002

Molecular Formula

C8H10N4O4 (C8 H10 N4 O4)

Compound Name

1,6-diacetyl-octahydro-[1,3]diazolo[4,5-d]imidazole-2,5-dione

IUPAC name

16-diacetyl-octahydro-[13]diazolo[45-d]imidazole-25-dione

SMILES

CC(N(C(C(N1)N2)N(C(C)=O)C2=O)C1=O)=O

InChI

InChI=1S/C8H10N4O4/c1-3(13)11-6-5(9-7(11)15)10-8(16)12(6)4(2)14/h5-6H,1-2H3,(H,9,15)(H,10,16)

InChI Key

NDMUOHYEWAXJQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05025236

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

226.19

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-1.775

Distribution Coefficient, logD

-1.779

Water Solubility, LogSw

-0.81

Polar Surface Area

81.474

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-5.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

4510-0002 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4510-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4510-0002?
Check Price and Availability of 4510-0002, 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 4510-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4510-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4510-0002
  • 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 4510-0002 available by request