4260-0870 Screening compound: ethyl 2-{2-[2-(4-bromo-3-methylphenoxy)acetamido]-1,3-thiazol-4-yl}acetate

4260-0870 Screening compound: ethyl 2-{2-[2-(4-bromo-3-methylphenoxy)acetamido]-1,3-thiazol-4-yl}acetate
4260-0870 Screening compound: ethyl 2-{2-[2-(4-bromo-3-methylphenoxy)acetamido]-1,3-thiazol-4-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4260-0870
ethyl 2-{2-[2-(4-bromo-3-methylphenoxy)acetamido]-1,3-thiazol-4-yl}acetate

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

4260-0870

Molecular Formula

C16H17BrN2O4S (C16 H17 BrN2 O4 S)

Compound Name

ethyl 2-{2-[2-(4-bromo-3-methylphenoxy)acetamido]-1,3-thiazol-4-yl}acetate

IUPAC name

ethyl 2-{2-[2-(4-bromo-3-methylphenoxy)acetamido]-13-thiazol-4-yl}acetate

SMILES

CCOC(Cc1csc(NC(COc(cc2)cc(C)c2Br)=O)n1)=O

InChI

InChI=1S/C16H17BrN2O4S/c1-3-22-15(21)7-11-9-24-16(18-11)19-14(20)8-23-12-4-5-13(17)10(2)6-12/h4-6,9H,3,7-8H2,1-2H3,(H,18,19,20)

InChI Key

VABAKGBSZLGFQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00751124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.084

Distribution Coefficient, logD

4.081

Water Solubility, LogSw

-4.26

Polar Surface Area

61.316

Acid Dissociation Constant (pKa)

9.63

Base Dissociation Constant (pKb)

-3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

References: we are preparing a list of scientific research reports with 4260-0870 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4260-0870?
Check Price and Availability of 4260-0870, 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 4260-0870 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4260-0870
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4260-0870
  • 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 4260-0870 available by request