4765-1913 Screening compound: (5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylideneimidazolidin-4-one

4765-1913 Screening compound: (5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylideneimidazolidin-4-one
4765-1913 Screening compound: (5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-sulfanylideneimidazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4765-1913
(5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]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

4765-1913

Molecular Formula

C14H8BrClN2O2S2 (C14 H8 BrClN2 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

O=C(/C(/N1)=C\c(o2)cc(Br)c2Sc(cc2)ccc2Cl)NC1=S

InChI

InChI=1S/C14H8BrClN2O2S2/c15-10-5-8(6-11-12(19)18-14(21)17-11)20-13(10)22-9-3-1-7(16)2-4-9/h1-6H,(H2,17,18,19,21)

InChI Key

KKKCNJKFSBERMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02604629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.605

Distribution Coefficient, logD

4.583

Water Solubility, LogSw

-4.79

Polar Surface Area

44.317

Acid Dissociation Constant (pKa)

8.67

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4765-1913 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4765-1913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4765-1913?
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What is the minimum amount of 4765-1913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4765-1913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4765-1913
  • 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 4765-1913 available by request