2151-0016 Screening compound: (5Z)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one

2151-0016 Screening compound: (5Z)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
2151-0016 Screening compound: (5Z)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2151-0016
(5Z)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-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

2151-0016

Molecular Formula

C12H9BrN2O3S2 (C12 H9 BrN2 O3 S2)

Compound Name

(5Z)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one

IUPAC name

(5Z)-5-[(4-bromo-3-nitrophenyl)methylidene]-3-ethyl-2-sulfanylidene-13-thiazolidin-4-one

SMILES

CCN(C(/C(/S1)=C/c(cc2)cc([N+]([O-])=O)c2Br)=O)C1=S

InChI

InChI=1S/C12H9BrN2O3S2/c1-2-14-11(16)10(20-12(14)19)6-7-3-4-8(13)9(5-7)15(17)18/h3-6H,2H2,1H3

InChI Key

WPHPNAAUVWAVLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01361120

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.25

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.623

Distribution Coefficient, logD

3.623

Water Solubility, LogSw

-4.01

Polar Surface Area

49.519

Acid Dissociation Constant (pKa)

30.32

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 2151-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2151-0016?
Check Price and Availability of 2151-0016, 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 2151-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2151-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2151-0016
  • 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 2151-0016 available by request