8020-1974 Screening compound: N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-(chloromethyl)benzamide

8020-1974 Screening compound: N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-(chloromethyl)benzamide
8020-1974 Screening compound: N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-(chloromethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1974
N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-(chloromethyl)benzamide

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

8020-1974

Molecular Formula

C17H16Cl2N4O (C17 H16 Cl2 N4 O)

Compound Name

N-{5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}-3-(chloromethyl)benzamide

IUPAC name

N-{5-chloro-146-trimethyl-1H-pyrazolo[34-b]pyridin-3-yl}-3-(chloromethyl)benzamide

SMILES

Cc1c(c(NC(c2cc(CCl)ccc2)=O)nn2C)c2nc(C)c1Cl

InChI

InChI=1S/C17H16Cl2N4O/c1-9-13-15(22-23(3)16(13)20-10(2)14(9)19)21-17(24)12-6-4-5-11(7-12)8-18/h4-7H,8H2,1-3H3,(H,21,22,24)

InChI Key

LPAYNVXTWQXRQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12035442

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.439

Distribution Coefficient, logD

1.738

Water Solubility, LogSw

-4.34

Polar Surface Area

47.786

Acid Dissociation Constant (pKa)

5.71

Base Dissociation Constant (pKb)

1.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with 8020-1974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1974?
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What is the minimum amount of 8020-1974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1974
  • 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 8020-1974 available by request