8020-1975 Screening compound: N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-cyclopentylpropanamide

8020-1975 Screening compound: N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-cyclopentylpropanamide
8020-1975 Screening compound: N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-cyclopentylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1975
N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-cyclopentylpropanamide

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

8020-1975

Molecular Formula

C17H23ClN4O (C17 H23 ClN4 O)

Compound Name

N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-cyclopentylpropanamide

IUPAC name

N-{5-chloro-146-trimethyl-1H-pyrazolo[34-b]pyridin-3-yl}-3-cyclopentylpropanamide

SMILES

Cc1c(c(NC(CCC2CCCC2)=O)nn2C)c2nc(C)c1Cl

InChI

InChI=1S/C17H23ClN4O/c1-10-14-16(20-13(23)9-8-12-6-4-5-7-12)21-22(3)17(14)19-11(2)15(10)18/h12H,4-9H2,1-3H3,(H,20,21,23)

InChI Key

ARXKWKJSYIVKNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12035443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.629

Distribution Coefficient, logD

3.400

Water Solubility, LogSw

-4.40

Polar Surface Area

48.131

Acid Dissociation Constant (pKa)

7.56

Base Dissociation Constant (pKb)

2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

8020-1975 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8020-1975 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1975?
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What is the minimum amount of 8020-1975 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1975
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1975
  • 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 8020-1975 available by request