0599-0780 Screening compound: 3,5-dibromo-2-hydroxy-N-(3,4,5-trichlorophenyl)benzamide

0599-0780 Screening compound: 3,5-dibromo-2-hydroxy-N-(3,4,5-trichlorophenyl)benzamide
0599-0780 Screening compound: 3,5-dibromo-2-hydroxy-N-(3,4,5-trichlorophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0599-0780
3,5-dibromo-2-hydroxy-N-(3,4,5-trichlorophenyl)benzamide

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

0599-0780

Molecular Formula

C13H6Br2Cl3NO2 (C13 H6 Br2 Cl3 NO2)

Compound Name

3,5-dibromo-2-hydroxy-N-(3,4,5-trichlorophenyl)benzamide

IUPAC name

35-dibromo-2-hydroxy-N-(345-trichlorophenyl)benzamide

SMILES

Oc(c(C(Nc(cc1Cl)cc(Cl)c1Cl)=O)cc(Br)c1)c1Br

InChI

InChI=1S/C13H6Br2Cl3NO2/c14-5-1-7(12(20)8(15)2-5)13(21)19-6-3-9(16)11(18)10(17)4-6/h1-4,20H,(H,19,21)

InChI Key

BAYTYZLFMKIUOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00681352

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.793

Distribution Coefficient, logD

2.507

Water Solubility, LogSw

-6.42

Polar Surface Area

38.809

Acid Dissociation Constant (pKa)

3.11

Base Dissociation Constant (pKb)

-5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0599-0780 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0599-0780 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0599-0780?
Check Price and Availability of 0599-0780, 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 0599-0780 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0599-0780
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0599-0780
  • 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 0599-0780 available by request