2742-2937 Screening compound: N-(4-fluorophenyl)-2-{3-[2-(4-methoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide

2742-2937 Screening compound: N-(4-fluorophenyl)-2-{3-[2-(4-methoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
2742-2937 Screening compound: N-(4-fluorophenyl)-2-{3-[2-(4-methoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2742-2937
N-(4-fluorophenyl)-2-{3-[2-(4-methoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}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

2742-2937

Molecular Formula

C21H22FN3O3S (C21 H22 FN3 O3 S)

Compound Name

N-(4-fluorophenyl)-2-{3-[2-(4-methoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide

IUPAC name

N-(4-fluorophenyl)-2-{3-[2-(4-methoxyphenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide

SMILES

CN(C(C(CC(Nc(cc1)ccc1F)=O)N1CCc(cc2)ccc2OC)=O)C1=S

InChI

InChI=1S/C21H22FN3O3S/c1-24-20(27)18(13-19(26)23-16-7-5-15(22)6-8-16)25(21(24)29)12-11-14-3-9-17(28-2)10-4-14/h3-10,18H,11-13H2,1-2H3,(H,23,26)/t18-/m1/s1

InChI Key

KPCJTTGVHCCKOZ-GOSISDBHSA-N

MDL Number (MFCD)

MFCD02142604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.664

Distribution Coefficient, logD

2.664

Water Solubility, LogSw

-3.27

Polar Surface Area

49.568

Acid Dissociation Constant (pKa)

10.39

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

2742-2937 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2742-2937 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2742-2937?
Check Price and Availability of 2742-2937, 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 2742-2937 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2742-2937
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2742-2937
  • 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 2742-2937 available by request