D278-0008 Screening compound: N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine

D278-0008 Screening compound: N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine
D278-0008 Screening compound: N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D278-0008
N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine

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

D278-0008

Molecular Formula

C13H14ClN3S (C13 H14 ClN3 S)

Compound Name

N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine

IUPAC name

N-[(4-chlorophenyl)methyl]-6-methyl-2-(methylsulfanyl)pyrimidin-4-amine

SMILES

Cc1cc(NCc(cc2)ccc2Cl)nc(SC)n1

InChI

InChI=1S/C13H14ClN3S/c1-9-7-12(17-13(16-9)18-2)15-8-10-3-5-11(14)6-4-10/h3-7H,8H2,1-2H3,(H,15,16,17)

InChI Key

XQFGDXQKKWPKPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09982453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.79

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.630

Distribution Coefficient, logD

3.622

Water Solubility, LogSw

-3.98

Polar Surface Area

28.140

Acid Dissociation Constant (pKa)

16.09

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

D278-0008 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

CNS Targets (44014 compounds)

Antibacterial Compounds Library (13827 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cardiovascular
Agro:
  • Agro
  • Agro
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D278-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D278-0008?
Check Price and Availability of D278-0008, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D278-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D278-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D278-0008
  • 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 D278-0008 available by request