Y032-0834 Screening compound: dimethyl 2-[(2,2,2-trichloroacetyl)amino]terephthalate

Y032-0834 Screening compound: dimethyl 2-[(2,2,2-trichloroacetyl)amino]terephthalate
Y032-0834 Screening compound: dimethyl 2-[(2,2,2-trichloroacetyl)amino]terephthalate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-0834
dimethyl 2-[(2,2,2-trichloroacetyl)amino]terephthalate

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

Y032-0834

Molecular Formula

C12H10Cl3NO5 (C12 H10 Cl3 NO5)

Compound Name

dimethyl 2-[(2,2,2-trichloroacetyl)amino]terephthalate

IUPAC name

14-dimethyl 2-(222-trichloroacetamido)benzene-14-dicarboxylate

SMILES

COC(c(cc1)cc(NC(C(Cl)(Cl)Cl)=O)c1C(OC)=O)=O

InChI

InChI=1S/C12H10Cl3NO5/c1-20-9(17)6-3-4-7(10(18)21-2)8(5-6)16-11(19)12(13,14)15/h3-5H,1-2H3,(H,16,19)

InChI Key

HSZVUJORSGYUKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02038630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.167

Distribution Coefficient, logD

-0.633

Water Solubility, LogSw

-3.66

Polar Surface Area

65.251

Acid Dissociation Constant (pKa)

3.60

Base Dissociation Constant (pKb)

-8.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with Y032-0834 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-0834?
Check Price and Availability of Y032-0834, 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 Y032-0834 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-0834
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-0834
  • 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 Y032-0834 available by request