3334-3995 Screening compound: 1-(4-chlorophenyl)-3-{[(furan-2-yl)methyl]sulfanyl}-3-(thiophen-2-yl)propan-1-one

3334-3995 Screening compound: 1-(4-chlorophenyl)-3-{[(furan-2-yl)methyl]sulfanyl}-3-(thiophen-2-yl)propan-1-one
3334-3995 Screening compound: 1-(4-chlorophenyl)-3-{[(furan-2-yl)methyl]sulfanyl}-3-(thiophen-2-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3334-3995
1-(4-chlorophenyl)-3-{[(furan-2-yl)methyl]sulfanyl}-3-(thiophen-2-yl)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

3334-3995

Molecular Formula

C18H15ClO2S2 (C18 H15 ClO2 S2)

Compound Name

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

IUPAC name

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

SMILES

O=C(CC(c1cccs1)SCc1ccco1)c(cc1)ccc1Cl

InChI

InChI=1S/C18H15ClO2S2/c19-14-7-5-13(6-8-14)16(20)11-18(17-4-2-10-22-17)23-12-15-3-1-9-21-15/h1-10,18H,11-12H2/t18-/m0/s1

InChI Key

CWKHSMGWBXNSLJ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD02251620

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.323

Distribution Coefficient, logD

5.323

Water Solubility, LogSw

-6.11

Polar Surface Area

21.709

Acid Dissociation Constant (pKa)

19.78

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 3334-3995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3334-3995?
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What is the minimum amount of 3334-3995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3334-3995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3334-3995
  • 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 3334-3995 available by request