D094-0031 Screening compound: 1-{9-[2-(diethylamino)ethyl]-2-methyl-9H-imidazo[1,2-a][1,3]benzimidazol-3-yl}-1-ethanone

D094-0031 Screening compound: 1-{9-[2-(diethylamino)ethyl]-2-methyl-9H-imidazo[1,2-a][1,3]benzimidazol-3-yl}-1-ethanone
D094-0031 Screening compound: 1-{9-[2-(diethylamino)ethyl]-2-methyl-9H-imidazo[1,2-a][1,3]benzimidazol-3-yl}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound D094-0031
1-{9-[2-(diethylamino)ethyl]-2-methyl-9H-imidazo[1,2-a][1,3]benzimidazol-3-yl}-1-ethanone

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

D094-0031

Molecular Formula

C18H24N4O (C18 H24 N4 O)

Compound Name

1-{9-[2-(diethylamino)ethyl]-2-methyl-9H-imidazo[1,2-a][1,3]benzimidazol-3-yl}-1-ethanone

IUPAC name

1-{7-[2-(diethylamino)ethyl]-4-methyl-257-triazatricyclo[6.4.0.0^{26}]dodeca-1(12)35810-pentaen-3-yl}ethan-1-one

SMILES

CCN(CC)CCn1c2nc(C)c(C(C)=O)n2c2c1cccc2

InChI

InChI=1S/C18H24N4O/c1-5-20(6-2)11-12-21-15-9-7-8-10-16(15)22-17(14(4)23)13(3)19-18(21)22/h7-10H,5-6,11-12H2,1-4H3

InChI Key

DOUUUERNMPTHEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01925376

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

312.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.654

Distribution Coefficient, logD

1.109

Water Solubility, LogSw

-2.60

Polar Surface Area

28.186

Acid Dissociation Constant (pKa)

19.67

Base Dissociation Constant (pKb)

8.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

D094-0031 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

CNS BBB Library (22607 compounds)

Immunological Library (6760 compounds)

Soluble Diversity Library (15920 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with D094-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D094-0031?
Check Price and Availability of D094-0031, 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 D094-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D094-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D094-0031
  • 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 D094-0031 available by request