C239-0797 Screening compound: 4-bromo-2-{6-[(2,6-dimethylphenyl)amino]-3H-imidazo[1,2-b][1,2,4]triazol-5-yl}phenol

C239-0797 Screening compound: 4-bromo-2-{6-[(2,6-dimethylphenyl)amino]-3H-imidazo[1,2-b][1,2,4]triazol-5-yl}phenol
C239-0797 Screening compound: 4-bromo-2-{6-[(2,6-dimethylphenyl)amino]-3H-imidazo[1,2-b][1,2,4]triazol-5-yl}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound C239-0797
4-bromo-2-{6-[(2,6-dimethylphenyl)amino]-3H-imidazo[1,2-b][1,2,4]triazol-5-yl}phenol

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

C239-0797

Molecular Formula

C18H16BrN5O (C18 H16 BrN5 O)

Compound Name

4-bromo-2-{6-[(2,6-dimethylphenyl)amino]-3H-imidazo[1,2-b][1,2,4]triazol-5-yl}phenol

IUPAC name

4-bromo-2-{6-[(26-dimethylphenyl)amino]-3H-imidazo[12-b][124]triazol-5-yl}phenol

SMILES

Cc1cccc(C)c1Nc1c(-c(cc(cc2)Br)c2O)nc2n1nc[nH]2

InChI

InChI=1S/C18H16BrN5O/c1-10-4-3-5-11(2)15(10)22-17-16(23-18-20-9-21-24(17)18)13-8-12(19)6-7-14(13)25/h3-9,22,25H,1-2H3,(H,20,21,23)

InChI Key

YBGLXTZPZACUGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08683000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.357

Distribution Coefficient, logD

4.198

Water Solubility, LogSw

-4.05

Polar Surface Area

56.994

Acid Dissociation Constant (pKa)

7.78

Base Dissociation Constant (pKb)

5.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

C239-0797 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Arginase Targeted Library (2009 compounds)

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

Targeted Diversity Library (40567 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
  • Infections
  • Immune system
  • animal
Targets:
  • Others

References: we are preparing a list of scientific research reports with C239-0797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C239-0797?
Check Price and Availability of C239-0797, 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 C239-0797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C239-0797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C239-0797
  • 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 C239-0797 available by request