4299-0762 Screening compound: (5Z)-5-{[3-bromo-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-methyl-1,3-thiazolidine-2,4-dione

4299-0762 Screening compound: (5Z)-5-{[3-bromo-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-methyl-1,3-thiazolidine-2,4-dione
4299-0762 Screening compound: (5Z)-5-{[3-bromo-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-methyl-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4299-0762
(5Z)-5-{[3-bromo-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-methyl-1,3-thiazolidine-2,4-dione

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

4299-0762

Molecular Formula

C14H12BrNO3S (C14 H12 BrNO3 S)

Compound Name

(5Z)-5-{[3-bromo-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-methyl-1,3-thiazolidine-2,4-dione

IUPAC name

(5Z)-5-{[3-bromo-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-methyl-13-thiazolidine-24-dione

SMILES

CN(C(/C(/S1)=C/c(cc2)cc(Br)c2OCC=C)=O)C1=O

InChI

InChI=1S/C14H12BrNO3S/c1-3-6-19-11-5-4-9(7-10(11)15)8-12-13(17)16(2)14(18)20-12/h3-5,7-8H,1,6H2,2H3

InChI Key

PPSSJUATBDWHDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02629239

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.22

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.594

Distribution Coefficient, logD

3.594

Water Solubility, LogSw

-3.79

Polar Surface Area

37.137

Acid Dissociation Constant (pKa)

31.12

Base Dissociation Constant (pKb)

-3.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with 4299-0762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4299-0762?
Check Price and Availability of 4299-0762, 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 4299-0762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4299-0762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4299-0762
  • 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 4299-0762 available by request