C249-0033 Screening compound: (2Z,4Z)-2,4-bis[(3-chlorophenyl)methylidene]thiolan-3-one

C249-0033 Screening compound: (2Z,4Z)-2,4-bis[(3-chlorophenyl)methylidene]thiolan-3-one
C249-0033 Screening compound: (2Z,4Z)-2,4-bis[(3-chlorophenyl)methylidene]thiolan-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C249-0033
(2Z,4Z)-2,4-bis[(3-chlorophenyl)methylidene]thiolan-3-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

C249-0033

Molecular Formula

C18H12Cl2OS (C18 H12 Cl2 OS)

Compound Name

(2Z,4Z)-2,4-bis[(3-chlorophenyl)methylidene]thiolan-3-one

IUPAC name

(2Z4Z)-24-bis[(3-chlorophenyl)methylidene]thiolan-3-one

SMILES

O=C(/C(/CS1)=C/c2cc(Cl)ccc2)/C1=C/c1cccc(Cl)c1

InChI

InChI=1S/C18H12Cl2OS/c19-15-5-1-3-12(8-15)7-14-11-22-17(18(14)21)10-13-4-2-6-16(20)9-13/h1-10H,11H2

InChI Key

BMDSBTRLLYMQPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03829606

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

5.736

Distribution Coefficient, logD

5.736

Water Solubility, LogSw

-6.06

Polar Surface Area

13.400

Acid Dissociation Constant (pKa)

26.52

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

References: we are preparing a list of scientific research reports with C249-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C249-0033?
Check Price and Availability of C249-0033, 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 C249-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C249-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C249-0033
  • 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 C249-0033 available by request