J015-0353 Screening compound: 2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide

J015-0353 Screening compound: 2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide
J015-0353 Screening compound: 2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J015-0353
2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide

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

J015-0353

Molecular Formula

C16H12ClIN4O2 (C16 H12 ClIN4 O2)

Compound Name

2-[4-chloro-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide

IUPAC name

2-[4-chloro-2-(4H-124-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide

SMILES

O=C(COc(ccc(Cl)c1)c1-n1cnnc1)Nc(cc1)ccc1I

InChI

InChI=1S/C16H12ClIN4O2/c17-11-1-6-15(14(7-11)22-9-19-20-10-22)24-8-16(23)21-13-4-2-12(18)3-5-13/h1-7,9-10H,8H2,(H,21,23)

InChI Key

GVKQXXAAZBFXQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15078259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.65

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.853

Distribution Coefficient, logD

3.853

Water Solubility, LogSw

-4.38

Polar Surface Area

56.433

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

5.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

References: we are preparing a list of scientific research reports with J015-0353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J015-0353?
Check Price and Availability of J015-0353, 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 J015-0353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J015-0353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J015-0353
  • 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 J015-0353 available by request