8018-7599 Screening compound: N-{1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide

8018-7599 Screening compound: N-{1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide
8018-7599 Screening compound: N-{1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7599
N-{1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl}cyclopropanecarboxamide

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

8018-7599

Molecular Formula

C13H16N4O (C13 H16 N4 O)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(c(NC(C2CC2)=O)nn2C)c2nc(C)c1

InChI

InChI=1S/C13H16N4O/c1-7-6-8(2)14-12-10(7)11(16-17(12)3)15-13(18)9-4-5-9/h6,9H,4-5H2,1-3H3,(H,15,16,18)

InChI Key

NTMUMEOLGHKQTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03617730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

244.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.764

Distribution Coefficient, logD

1.740

Water Solubility, LogSw

-2.41

Polar Surface Area

47.539

Acid Dissociation Constant (pKa)

8.65

Base Dissociation Constant (pKb)

4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

8018-7599 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 8018-7599 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7599?
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What is the minimum amount of 8018-7599 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7599
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7599
  • 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 8018-7599 available by request