K205-0876 Screening compound: 1,3-dimethyl 5-{4-oxo-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}benzene-1,3-dicarboxylate

K205-0876 Screening compound: 1,3-dimethyl 5-{4-oxo-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}benzene-1,3-dicarboxylate
K205-0876 Screening compound: 1,3-dimethyl 5-{4-oxo-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}benzene-1,3-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K205-0876
1,3-dimethyl 5-{4-oxo-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}benzene-1,3-dicarboxylate

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

K205-0876

Molecular Formula

C20H16F3NO5S (C20 H16 F3 NO5 S)

Compound Name

1,3-dimethyl 5-{4-oxo-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl}benzene-1,3-dicarboxylate

IUPAC name

13-dimethyl 5-{4-oxo-2-[3-(trifluoromethyl)phenyl]-13-thiazolidin-3-yl}benzene-13-dicarboxylate

SMILES

COC(c1cc(N(C(c2cc(C(F)(F)F)ccc2)SC2)C2=O)cc(C(OC)=O)c1)=O

InChI

InChI=1S/C20H16F3NO5S/c1-28-18(26)12-6-13(19(27)29-2)9-15(8-12)24-16(25)10-30-17(24)11-4-3-5-14(7-11)20(21,22)23/h3-9,17H,10H2,1-2H3/t17-/m0/s1

InChI Key

VFWSSFQTGBIPPA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD01933380

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.347

Distribution Coefficient, logD

4.347

Water Solubility, LogSw

-4.54

Polar Surface Area

58.481

Acid Dissociation Constant (pKa)

14.79

Base Dissociation Constant (pKb)

-15.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

K205-0876 in Drug Discovery

Included in Screening Libraries

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with K205-0876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K205-0876?
Check Price and Availability of K205-0876, 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 K205-0876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K205-0876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K205-0876
  • 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 K205-0876 available by request