F847-0382 Screening compound: methyl 2-(2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate

F847-0382 Screening compound: methyl 2-(2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate
F847-0382 Screening compound: methyl 2-(2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F847-0382
methyl 2-(2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate

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

F847-0382

Molecular Formula

C25H23N3O4S2 (C25 H23 N3 O4 S2)

Compound Name

methyl 2-(2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate

IUPAC name

methyl 2-(2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H4H-thieno[32-d]pyrimidin-2-yl]sulfanyl}acetamido)benzoate

SMILES

CCN(C1=O)C(SCC(Nc(cccc2)c2C(OC)=O)=O)=Nc2c1scc2-c1ccc(C)cc1

InChI

InChI=1S/C25H23N3O4S2/c1-4-28-23(30)22-21(18(13-33-22)16-11-9-15(2)10-12-16)27-25(28)34-14-20(29)26-19-8-6-5-7-17(19)24(31)32-3/h5-13H,4,14H2,1-3H3,(H,26,29)

InChI Key

NCPZYUKKAUOBEA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11997477

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.004

Distribution Coefficient, logD

4.995

Water Solubility, LogSw

-4.57

Polar Surface Area

67.887

Acid Dissociation Constant (pKa)

9.11

Base Dissociation Constant (pKb)

-2.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with F847-0382 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F847-0382?
Check Price and Availability of F847-0382, 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 F847-0382 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F847-0382
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F847-0382
  • 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 F847-0382 available by request