8019-3295 Screening compound: 2-(3-bromophenyl)-1-octadecyl-1H-1,3-benzodiazole

8019-3295 Screening compound: 2-(3-bromophenyl)-1-octadecyl-1H-1,3-benzodiazole
8019-3295 Screening compound: 2-(3-bromophenyl)-1-octadecyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3295
2-(3-bromophenyl)-1-octadecyl-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

8019-3295

Molecular Formula

C31H45BrN2 (C31 H45 BrN2)

Compound Name

2-(3-bromophenyl)-1-octadecyl-1H-1,3-benzodiazole

IUPAC name

2-(3-bromophenyl)-1-octadecyl-1H-13-benzodiazole

SMILES

CCCCCCCCCCCCCCCCCCn1c(-c2cccc(Br)c2)nc2c1cccc2

InChI

InChI=1S/C31H45BrN2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-34-30-24-18-17-23-29(30)33-31(34)27-21-20-22-28(32)26-27/h17-18,20-24,26H,2-16,19,25H2,1H3

InChI Key

VAGVNQDPWQQZAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02859102

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

525.62

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

18.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

13.095

Distribution Coefficient, logD

13.095

Water Solubility, LogSw

-6.08

Polar Surface Area

10.145

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.10

8019-3295 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8019-3295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3295?
Check Price and Availability of 8019-3295, 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 8019-3295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3295
  • 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 8019-3295 available by request