8016-0357 Screening compound: 3-ethyl-7-methoxy-5-phenyl-2H,3H-[1,3]thiazolo[4,5-d]pyrimidine-2-thione

8016-0357 Screening compound: 3-ethyl-7-methoxy-5-phenyl-2H,3H-[1,3]thiazolo[4,5-d]pyrimidine-2-thione
8016-0357 Screening compound: 3-ethyl-7-methoxy-5-phenyl-2H,3H-[1,3]thiazolo[4,5-d]pyrimidine-2-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-0357
3-ethyl-7-methoxy-5-phenyl-2H,3H-[1,3]thiazolo[4,5-d]pyrimidine-2-thione

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

8016-0357

Molecular Formula

C14H13N3OS2 (C14 H13 N3 OS2)

Compound Name

3-ethyl-7-methoxy-5-phenyl-2H,3H-[1,3]thiazolo[4,5-d]pyrimidine-2-thione

IUPAC name

3-ethyl-7-methoxy-5-phenyl-2H3H-[13]thiazolo[45-d]pyrimidine-2-thione

SMILES

CCN(c(nc(-c1ccccc1)nc1OC)c1S1)C1=S

InChI

InChI=1S/C14H13N3OS2/c1-3-17-12-10(20-14(17)19)13(18-2)16-11(15-12)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3

InChI Key

VDDROWYKSGWTKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05259839

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.689

Distribution Coefficient, logD

4.689

Water Solubility, LogSw

-4.44

Polar Surface Area

30.538

Acid Dissociation Constant (pKa)

25.26

Base Dissociation Constant (pKb)

0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

8016-0357 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8016-0357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-0357?
Check Price and Availability of 8016-0357, 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 8016-0357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-0357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-0357
  • 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 8016-0357 available by request