3229-2704 Screening compound: (5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-sulfanylideneimidazolidin-4-one

3229-2704 Screening compound: (5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-sulfanylideneimidazolidin-4-one
3229-2704 Screening compound: (5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-sulfanylideneimidazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3229-2704
(5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-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

3229-2704

Molecular Formula

C14H9BrN2O2S (C14 H9 BrN2 O2 S)

Compound Name

(5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-sulfanylideneimidazolidin-4-one

IUPAC name

(5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-2-sulfanylideneimidazolidin-4-one

SMILES

O=C(/C(/N1)=C\c2ccc(-c(cc3)ccc3Br)o2)NC1=S

InChI

InChI=1S/C14H9BrN2O2S/c15-9-3-1-8(2-4-9)12-6-5-10(19-12)7-11-13(18)17-14(20)16-11/h1-7H,(H2,16,17,18,20)

InChI Key

WBLHWMQXLJEXDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02906100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.21

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.862

Distribution Coefficient, logD

3.839

Water Solubility, LogSw

-4.29

Polar Surface Area

43.864

Acid Dissociation Constant (pKa)

8.67

Base Dissociation Constant (pKb)

0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3229-2704 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3229-2704 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3229-2704?
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What is the minimum amount of 3229-2704 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3229-2704
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3229-2704
  • 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 3229-2704 available by request