7518-0013 Screening compound: 2-[2-(tert-butyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]-1-ethanol

7518-0013 Screening compound: 2-[2-(tert-butyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]-1-ethanol
7518-0013 Screening compound: 2-[2-(tert-butyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]-1-ethanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 7518-0013
2-[2-(tert-butyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]-1-ethanol

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

7518-0013

Molecular Formula

C15H19N3O (C15 H19 N3 O)

Compound Name

2-[2-(tert-butyl)-1H-imidazo[1,2-a][1,3]benzimidazol-1-yl]-1-ethanol

IUPAC name

2-{4-tert-butyl-257-triazatricyclo[6.4.0.0^{26}]dodeca-1(12)36810-pentaen-5-yl}ethan-1-ol

SMILES

CC(C)(C)c(n1CCO)cn2c1nc1c2cccc1

InChI

InChI=1S/C15H19N3O/c1-15(2,3)13-10-18-12-7-5-4-6-11(12)16-14(18)17(13)8-9-19/h4-7,10,19H,8-9H2,1-3H3

InChI Key

CETCNKJYQAJPEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00965882

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

257.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.859

Distribution Coefficient, logD

2.520

Water Solubility, LogSw

-2.67

Polar Surface Area

27.936

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

7518-0013 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 7518-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7518-0013?
Check Price and Availability of 7518-0013, 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 7518-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7518-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7518-0013
  • 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 7518-0013 available by request