5371-3925 Screening compound: (5Z)-5-({4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one

5371-3925 Screening compound: (5Z)-5-({4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one
5371-3925 Screening compound: (5Z)-5-({4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5371-3925
(5Z)-5-({4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-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

5371-3925

Molecular Formula

C18H15FN2O2S (C18 H15 FN2 O2 S)

Compound Name

(5Z)-5-({4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one

IUPAC name

(5Z)-5-({4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one

SMILES

CN(C(/C(/N1)=C/c(cc2)ccc2OCc(cccc2)c2F)=O)C1=S

InChI

InChI=1S/C18H15FN2O2S/c1-21-17(22)16(20-18(21)24)10-12-6-8-14(9-7-12)23-11-13-4-2-3-5-15(13)19/h2-10H,11H2,1H3,(H,20,24)

InChI Key

QKHYYHQPMIESEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03137904

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.391

Distribution Coefficient, logD

3.382

Water Solubility, LogSw

-3.71

Polar Surface Area

34.773

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

-3.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

5371-3925 in Drug Discovery

Included in Screening Libraries

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5371-3925 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5371-3925?
Check Price and Availability of 5371-3925, 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 5371-3925 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5371-3925
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5371-3925
  • 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 5371-3925 available by request