8020-8290 Screening compound: 2-amino-6-(butylsulfanyl)-4-(4-methylbenzoyl)-3,5-pyridinedicarbonitrile

8020-8290 Screening compound: 2-amino-6-(butylsulfanyl)-4-(4-methylbenzoyl)-3,5-pyridinedicarbonitrile
8020-8290 Screening compound: 2-amino-6-(butylsulfanyl)-4-(4-methylbenzoyl)-3,5-pyridinedicarbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-8290
2-amino-6-(butylsulfanyl)-4-(4-methylbenzoyl)-3,5-pyridinedicarbonitrile

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

8020-8290

Molecular Formula

C19H18N4OS (C19 H18 N4 OS)

Compound Name

2-amino-6-(butylsulfanyl)-4-(4-methylbenzoyl)-3,5-pyridinedicarbonitrile

IUPAC name

2-amino-6-(butylsulfanyl)-4-(4-methylbenzoyl)pyridine-35-dicarbonitrile

SMILES

CCCCSc(c(C#N)c1C(c2ccc(C)cc2)=O)nc(N)c1C#N

InChI

InChI=1S/C19H18N4OS/c1-3-4-9-25-19-15(11-21)16(14(10-20)18(22)23-19)17(24)13-7-5-12(2)6-8-13/h5-8H,3-4,9H2,1-2H3,(H2,22,23)

InChI Key

IONSOVGXMABWAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31943922

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.323

Distribution Coefficient, logD

4.323

Water Solubility, LogSw

-4.50

Polar Surface Area

77.262

Acid Dissociation Constant (pKa)

14.66

Base Dissociation Constant (pKb)

-4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.32

References: we are preparing a list of scientific research reports with 8020-8290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-8290?
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What is the minimum amount of 8020-8290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-8290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-8290
  • 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 8020-8290 available by request