D268-0111 Screening compound: N5-(4-bromophenyl)-N6-(2,3-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

D268-0111 Screening compound: N5-(4-bromophenyl)-N6-(2,3-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
D268-0111 Screening compound: N5-(4-bromophenyl)-N6-(2,3-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound D268-0111
N5-(4-bromophenyl)-N6-(2,3-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

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

D268-0111

Molecular Formula

C18H15BrN6O (C18 H15 BrN6 O)

Compound Name

N5-(4-bromophenyl)-N6-(2,3-dimethylphenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine

IUPAC name

N5-(4-bromophenyl)-N6-(23-dimethylphenyl)-[125]oxadiazolo[34-b]pyrazine-56-diamine

SMILES

Cc1cccc(Nc2nc3nonc3nc2Nc(cc2)ccc2Br)c1C

InChI

InChI=1S/C18H15BrN6O/c1-10-4-3-5-14(11(10)2)21-16-15(20-13-8-6-12(19)7-9-13)22-17-18(23-16)25-26-24-17/h3-9H,1-2H3,(H,20,22,24)(H,21,23,25)

InChI Key

JMSJOKYHEKAQEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00363736

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.239

Distribution Coefficient, logD

6.239

Water Solubility, LogSw

-5.85

Polar Surface Area

73.848

Acid Dissociation Constant (pKa)

15.77

Base Dissociation Constant (pKb)

-2.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D268-0111 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D268-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D268-0111?
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What is the minimum amount of D268-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D268-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D268-0111
  • 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 D268-0111 available by request