D041-0032 Screening compound: N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)-2-(methylsulfanyl)pyrimidin-5-amine

D041-0032 Screening compound: N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)-2-(methylsulfanyl)pyrimidin-5-amine
D041-0032 Screening compound: N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)-2-(methylsulfanyl)pyrimidin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D041-0032
N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)-2-(methylsulfanyl)pyrimidin-5-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

D041-0032

Molecular Formula

C15H14N4S2 (C15 H14 N4 S2)

Compound Name

N-(4-methyl-5-phenyl-1,3-thiazol-2-yl)-2-(methylsulfanyl)pyrimidin-5-amine

IUPAC name

N-(4-methyl-5-phenyl-13-thiazol-2-yl)-2-(methylsulfanyl)pyrimidin-5-amine

SMILES

Cc1c(-c2ccccc2)sc(Nc(cn2)cnc2SC)n1

InChI

InChI=1S/C15H14N4S2/c1-10-13(11-6-4-3-5-7-11)21-15(18-10)19-12-8-16-14(20-2)17-9-12/h3-9H,1-2H3,(H,18,19)

InChI Key

PPJBJOBKULUIMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02709701

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.19

Polar Surface Area

37.839

Acid Dissociation Constant (pKa)

18.42

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

D041-0032 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
  • Epigenetic
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with D041-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D041-0032?
Check Price and Availability of D041-0032, 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 D041-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D041-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D041-0032
  • 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 D041-0032 available by request