6711-0084 Screening compound: 1-benzyl-3-(4-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridine

6711-0084 Screening compound: 1-benzyl-3-(4-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridine
6711-0084 Screening compound: 1-benzyl-3-(4-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6711-0084
1-benzyl-3-(4-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridine

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

6711-0084

Molecular Formula

C22H21N3O (C22 H21 N3 O)

Compound Name

1-benzyl-3-(4-methoxyphenyl)-4,6-dimethyl-1H-pyrazolo[3,4-b]pyridine

IUPAC name

1-benzyl-3-(4-methoxyphenyl)-46-dimethyl-1H-pyrazolo[34-b]pyridine

SMILES

Cc1c(c(-c(cc2)ccc2OC)nn2Cc3ccccc3)c2nc(C)c1

InChI

InChI=1S/C22H21N3O/c1-15-13-16(2)23-22-20(15)21(18-9-11-19(26-3)12-10-18)24-25(22)14-17-7-5-4-6-8-17/h4-13H,14H2,1-3H3

InChI Key

PXIVBWBTYIXNCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05987770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.568

Distribution Coefficient, logD

4.568

Water Solubility, LogSw

-4.70

Polar Surface Area

30.770

Acid Dissociation Constant (pKa)

25.47

Base Dissociation Constant (pKb)

4.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

6711-0084 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6711-0084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6711-0084?
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What is the minimum amount of 6711-0084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6711-0084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6711-0084
  • 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 6711-0084 available by request