8019-5526 Screening compound: 6-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione

8019-5526 Screening compound: 6-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione
8019-5526 Screening compound: 6-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-5526
6-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione

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

8019-5526

Molecular Formula

C18H14N4O2 (C18 H14 N4 O2)

Compound Name

6-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione

IUPAC name

6-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-5H6H7H-pyrrolo[34-b]pyridine-57-dione

SMILES

Cc([nH]nc1N(C(c2cccnc22)=O)C2=O)c1-c1ccc(C)cc1

InChI

InChI=1S/C18H14N4O2/c1-10-5-7-12(8-6-10)14-11(2)20-21-16(14)22-17(23)13-4-3-9-19-15(13)18(22)24/h3-9H,1-2H3,(H,20,21)

InChI Key

STUCYKGAIOXPIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10038218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.332

Distribution Coefficient, logD

2.332

Water Solubility, LogSw

-2.84

Polar Surface Area

61.788

Acid Dissociation Constant (pKa)

4.42

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.11

8019-5526 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8019-5526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-5526?
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What is the minimum amount of 8019-5526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-5526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-5526
  • 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 8019-5526 available by request