D700-0019 Screening compound: N~1~-[2-(1-cyclohexenyl)ethyl]-2-(2-phenyl-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl)acetamide

D700-0019 Screening compound: N~1~-[2-(1-cyclohexenyl)ethyl]-2-(2-phenyl-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl)acetamide
D700-0019 Screening compound: N~1~-[2-(1-cyclohexenyl)ethyl]-2-(2-phenyl-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D700-0019
N~1~-[2-(1-cyclohexenyl)ethyl]-2-(2-phenyl-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl)acetamide

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

D700-0019

Molecular Formula

C25H26N4O (C25 H26 N4 O)

Compound Name

N~1~-[2-(1-cyclohexenyl)ethyl]-2-(2-phenyl-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl)acetamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{4-phenyl-257-triazatricyclo[6.4.0.0^{26}]dodeca-1(12)36810-pentaen-5-yl}acetamide

SMILES

O=C(Cn1c2nc(cccc3)c3n2cc1-c1ccccc1)NCCC1=CCCCC1

InChI

InChI=1S/C25H26N4O/c30-24(26-16-15-19-9-3-1-4-10-19)18-29-23(20-11-5-2-6-12-20)17-28-22-14-8-7-13-21(22)27-25(28)29/h2,5-9,11-14,17H,1,3-4,10,15-16,18H2,(H,26,30)

InChI Key

IEARPPORTDKXKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596732

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.603

Distribution Coefficient, logD

4.539

Water Solubility, LogSw

-4.31

Polar Surface Area

35.264

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

6.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

D700-0019 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

DGK Inhibitors Library (10558 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with D700-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D700-0019?
Check Price and Availability of D700-0019, 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 D700-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D700-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D700-0019
  • 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 D700-0019 available by request