D011-4623 Screening compound: 1-[4-(4-chlorophenoxy)butyl]-1H-1,3-benzodiazole

D011-4623 Screening compound: 1-[4-(4-chlorophenoxy)butyl]-1H-1,3-benzodiazole
D011-4623 Screening compound: 1-[4-(4-chlorophenoxy)butyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D011-4623
1-[4-(4-chlorophenoxy)butyl]-1H-1,3-benzodiazole

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

D011-4623

Molecular Formula

C17H17ClN2O (C17 H17 ClN2 O)

Compound Name

1-[4-(4-chlorophenoxy)butyl]-1H-1,3-benzodiazole

IUPAC name

1-[4-(4-chlorophenoxy)butyl]-1H-13-benzodiazole

SMILES

Clc(cc1)ccc1OCCCCn1c(cccc2)c2nc1

InChI

InChI=1S/C17H17ClN2O/c18-14-7-9-15(10-8-14)21-12-4-3-11-20-13-19-16-5-1-2-6-17(16)20/h1-2,5-10,13H,3-4,11-12H2

InChI Key

XIVUATKMDIVNTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04333033

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

300.79

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.162

Distribution Coefficient, logD

4.160

Water Solubility, LogSw

-4.44

Polar Surface Area

17.819

Acid Dissociation Constant (pKa)

24.56

Base Dissociation Constant (pKb)

4.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D011-4623 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-infective Library (19449 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with D011-4623 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D011-4623?
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What is the minimum amount of D011-4623 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D011-4623
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D011-4623
  • 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 D011-4623 available by request