8020-1526 Screening compound: 4-(methoxymethyl)-6-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile

8020-1526 Screening compound: 4-(methoxymethyl)-6-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
8020-1526 Screening compound: 4-(methoxymethyl)-6-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1526
4-(methoxymethyl)-6-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile

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

8020-1526

Molecular Formula

C17H23N3O2S (C17 H23 N3 O2 S)

Compound Name

4-(methoxymethyl)-6-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile

IUPAC name

4-(methoxymethyl)-6-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile

SMILES

CC(CC1)CCN1C(CSc1nc(C)cc(COC)c1C#N)=O

InChI

InChI=1S/C17H23N3O2S/c1-12-4-6-20(7-5-12)16(21)11-23-17-15(9-18)14(10-22-3)8-13(2)19-17/h8,12H,4-7,10-11H2,1-3H3

InChI Key

LIVXWHYNVBLMFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06621499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.320

Distribution Coefficient, logD

2.320

Water Solubility, LogSw

-2.35

Polar Surface Area

50.393

Acid Dissociation Constant (pKa)

21.53

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

8020-1526 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8020-1526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1526?
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What is the minimum amount of 8020-1526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1526
  • 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 8020-1526 available by request