F847-0404 Screening compound: N-(2-chloro-4-methylphenyl)-2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

F847-0404 Screening compound: N-(2-chloro-4-methylphenyl)-2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
F847-0404 Screening compound: N-(2-chloro-4-methylphenyl)-2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F847-0404
N-(2-chloro-4-methylphenyl)-2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

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

F847-0404

Molecular Formula

C24H22ClN3O2S2 (C24 H22 ClN3 O2 S2)

Compound Name

N-(2-chloro-4-methylphenyl)-2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

IUPAC name

N-(2-chloro-4-methylphenyl)-2-{[3-ethyl-7-(4-methylphenyl)-4-oxo-3H4H-thieno[32-d]pyrimidin-2-yl]sulfanyl}acetamide

SMILES

CCN(C1=O)C(SCC(Nc(ccc(C)c2)c2Cl)=O)=Nc2c1scc2-c1ccc(C)cc1

InChI

InChI=1S/C24H22ClN3O2S2/c1-4-28-23(30)22-21(17(12-31-22)16-8-5-14(2)6-9-16)27-24(28)32-13-20(29)26-19-10-7-15(3)11-18(19)25/h5-12H,4,13H2,1-3H3,(H,26,29)

InChI Key

TVONHIDNDTUAHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11997660

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.04

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.003

Distribution Coefficient, logD

6.003

Water Solubility, LogSw

-5.96

Polar Surface Area

46.714

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

-1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with F847-0404 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F847-0404?
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What is the minimum amount of F847-0404 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F847-0404
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F847-0404
  • 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 F847-0404 available by request