3333-3155 Screening compound: 3-(4-chlorophenyl)-1-(furan-2-yl)-3-{[(furan-2-yl)methyl]sulfanyl}propan-1-one

3333-3155 Screening compound: 3-(4-chlorophenyl)-1-(furan-2-yl)-3-{[(furan-2-yl)methyl]sulfanyl}propan-1-one
3333-3155 Screening compound: 3-(4-chlorophenyl)-1-(furan-2-yl)-3-{[(furan-2-yl)methyl]sulfanyl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3333-3155
3-(4-chlorophenyl)-1-(furan-2-yl)-3-{[(furan-2-yl)methyl]sulfanyl}propan-1-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

3333-3155

Molecular Formula

C18H15ClO3S (C18 H15 ClO3 S)

Compound Name

3-(4-chlorophenyl)-1-(furan-2-yl)-3-{[(furan-2-yl)methyl]sulfanyl}propan-1-one

IUPAC name

3-(4-chlorophenyl)-1-(furan-2-yl)-3-{[(furan-2-yl)methyl]sulfanyl}propan-1-one

SMILES

O=C(CC(c(cc1)ccc1Cl)SCc1ccco1)c1ccco1

InChI

InChI=1S/C18H15ClO3S/c19-14-7-5-13(6-8-14)18(23-12-15-3-1-9-21-15)11-16(20)17-4-2-10-22-17/h1-10,18H,11-12H2/t18-/m0/s1

InChI Key

UGRVLCILSOGPPW-SFHVURJKSA-N

MDL Number (MFCD)

MFCD01972361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.955

Distribution Coefficient, logD

4.955

Water Solubility, LogSw

-5.39

Polar Surface Area

29.269

Acid Dissociation Constant (pKa)

19.09

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.67

3333-3155 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3333-3155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3333-3155?
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What is the minimum amount of 3333-3155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3333-3155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3333-3155
  • 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 3333-3155 available by request