D750-0234 Screening compound: N-[1-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)cyclohexyl]acetamide

D750-0234 Screening compound: N-[1-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)cyclohexyl]acetamide
D750-0234 Screening compound: N-[1-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)cyclohexyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D750-0234
N-[1-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)cyclohexyl]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

D750-0234

Molecular Formula

C25H28N4O2 (C25 H28 N4 O2)

Compound Name

N-[1-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)cyclohexyl]acetamide

IUPAC name

N-[1-(1H-13-benzodiazol-2-yl)ethyl]-2-[1-(1-oxo-23-dihydro-1H-isoindol-2-yl)cyclohexyl]acetamide

SMILES

CC(c1nc(cccc2)c2[nH]1)NC(CC1(CCCCC1)N(Cc1c2cccc1)C2=O)=O

InChI

InChI=1S/C25H28N4O2/c1-17(23-27-20-11-5-6-12-21(20)28-23)26-22(30)15-25(13-7-2-8-14-25)29-16-18-9-3-4-10-19(18)24(29)31/h3-6,9-12,17H,2,7-8,13-16H2,1H3,(H,26,30)(H,27,28)/t17-/m0/s1

InChI Key

KTAXWIZWOVYWGN-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32223296

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.541

Distribution Coefficient, logD

3.540

Water Solubility, LogSw

-3.67

Polar Surface Area

58.874

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

D750-0234 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Ion Channels Focused Library (26372 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D750-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D750-0234?
Check Price and Availability of D750-0234, 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 D750-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D750-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D750-0234
  • 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 D750-0234 available by request