0585-0729 Screening compound: 5-chloro-N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3-iodobenzamide

0585-0729 Screening compound: 5-chloro-N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3-iodobenzamide
0585-0729 Screening compound: 5-chloro-N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3-iodobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0585-0729
5-chloro-N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3-iodobenzamide

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

0585-0729

Molecular Formula

C23H13Cl3INO3 (C23 H13 Cl3 INO3)

Compound Name

5-chloro-N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3-iodobenzamide

IUPAC name

5-chloro-N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3-iodobenzamide

SMILES

Oc(c(C(Nc(cc(cc1)Cl)c1Oc(ccc1ccccc11)c1Cl)=O)cc(Cl)c1)c1I

InChI

InChI=1S/C23H13Cl3INO3/c24-13-6-8-19(31-20-7-5-12-3-1-2-4-15(12)21(20)26)18(11-13)28-23(30)16-9-14(25)10-17(27)22(16)29/h1-11,29H,(H,28,30)

InChI Key

WBBRWXSMKSSCLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28992294

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

584.62

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.501

Distribution Coefficient, logD

7.042

Water Solubility, LogSw

-6.43

Polar Surface Area

44.760

Acid Dissociation Constant (pKa)

5.96

Base Dissociation Constant (pKb)

-4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 0585-0729 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0585-0729?
Check Price and Availability of 0585-0729, 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 0585-0729 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0585-0729
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0585-0729
  • 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 0585-0729 available by request