D390-0778 Screening compound: 3-[(furan-2-yl)methyl]-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one

D390-0778 Screening compound: 3-[(furan-2-yl)methyl]-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one
D390-0778 Screening compound: 3-[(furan-2-yl)methyl]-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D390-0778
3-[(furan-2-yl)methyl]-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one

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

D390-0778

Molecular Formula

C17H12N2O2S (C17 H12 N2 O2 S)

Compound Name

3-[(furan-2-yl)methyl]-5-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one

IUPAC name

3-[(furan-2-yl)methyl]-5-phenyl-3H4H-thieno[23-d]pyrimidin-4-one

SMILES

O=C1N(Cc2ccco2)C=Nc2c1c(-c1ccccc1)cs2

InChI

InChI=1S/C17H12N2O2S/c20-17-15-14(12-5-2-1-3-6-12)10-22-16(15)18-11-19(17)9-13-7-4-8-21-13/h1-8,10-11H,9H2

InChI Key

FDXWYCMYMKSHDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12914930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.320

Distribution Coefficient, logD

3.320

Water Solubility, LogSw

-3.65

Polar Surface Area

33.718

Acid Dissociation Constant (pKa)

35.14

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

D390-0778 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D390-0778 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D390-0778?
Check Price and Availability of D390-0778, 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 D390-0778 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D390-0778
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D390-0778
  • 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 D390-0778 available by request