K906-0276 Screening compound: 2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl(2-nitrophenyl)methanone

K906-0276 Screening compound: 2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl(2-nitrophenyl)methanone
K906-0276 Screening compound: 2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl(2-nitrophenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-0276
2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl(2-nitrophenyl)methanone

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

K906-0276

Molecular Formula

C16H12N4O3 (C16 H12 N4 O3)

Compound Name

2,3-dihydro-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl(2-nitrophenyl)methanone

IUPAC name

5-(2-nitrobenzoyl)-257-triazatricyclo[6.4.0.0^{26}]dodeca-1(12)6810-tetraene

SMILES

[O-][N+](c(cccc1)c1C(N1c2nc(cccc3)c3n2CC1)=O)=O

InChI

InChI=1S/C16H12N4O3/c21-15(11-5-1-3-7-13(11)20(22)23)19-10-9-18-14-8-4-2-6-12(14)17-16(18)19/h1-8H,9-10H2

InChI Key

SJSREZQZYPZVPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03452516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.752

Distribution Coefficient, logD

2.444

Water Solubility, LogSw

-3.48

Polar Surface Area

58.925

Acid Dissociation Constant (pKa)

23.34

Base Dissociation Constant (pKb)

7.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

K906-0276 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K906-0276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-0276?
Check Price and Availability of K906-0276, 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 K906-0276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-0276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-0276
  • 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 K906-0276 available by request