8003-8066 Screening compound: 4-({6-[(3,4-dimethylphenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}amino)-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one

8003-8066 Screening compound: 4-({6-[(3,4-dimethylphenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}amino)-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one
8003-8066 Screening compound: 4-({6-[(3,4-dimethylphenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}amino)-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-8066
4-({6-[(3,4-dimethylphenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}amino)-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one

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

8003-8066

Molecular Formula

C23H22N8O2 (C23 H22 N8 O2)

Compound Name

4-({6-[(3,4-dimethylphenyl)amino]-[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}amino)-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one

IUPAC name

4-({6-[(34-dimethylphenyl)amino]-[125]oxadiazolo[34-b]pyrazin-5-yl}amino)-15-dimethyl-2-phenyl-23-dihydro-1H-pyrazol-3-one

SMILES

CC(N(C)N(C1=O)c2ccccc2)=C1Nc1nc2nonc2nc1Nc1cc(C)c(C)cc1

InChI

InChI=1S/C23H22N8O2/c1-13-10-11-16(12-14(13)2)24-19-20(27-22-21(26-19)28-33-29-22)25-18-15(3)30(4)31(23(18)32)17-8-6-5-7-9-17/h5-12H,1-4H3,(H,24,26,28)(H,25,27,29)

InChI Key

DBWGRFURMUKMLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00736326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.114

Distribution Coefficient, logD

3.179

Water Solubility, LogSw

-4.19

Polar Surface Area

94.927

Acid Dissociation Constant (pKa)

6.52

Base Dissociation Constant (pKb)

-10.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

8003-8066 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8003-8066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-8066?
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What is the minimum amount of 8003-8066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-8066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-8066
  • 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 8003-8066 available by request