8005-0803 Screening compound: 2,4-dibromo-6-[(E)-({2-[(2-bromophenyl)formamido]acetamido}imino)methyl]phenyl 3-methylbenzoate

8005-0803 Screening compound: 2,4-dibromo-6-[(E)-({2-[(2-bromophenyl)formamido]acetamido}imino)methyl]phenyl 3-methylbenzoate
8005-0803 Screening compound: 2,4-dibromo-6-[(E)-({2-[(2-bromophenyl)formamido]acetamido}imino)methyl]phenyl 3-methylbenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-0803
2,4-dibromo-6-[(E)-({2-[(2-bromophenyl)formamido]acetamido}imino)methyl]phenyl 3-methylbenzoate

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

8005-0803

Molecular Formula

C24H18Br3N3O4 (C24 H18 Br3 N3 O4)

Compound Name

2,4-dibromo-6-[(E)-({2-[(2-bromophenyl)formamido]acetamido}imino)methyl]phenyl 3-methylbenzoate

IUPAC name

24-dibromo-6-[(E)-({2-[(2-bromophenyl)formamido]acetamido}imino)methyl]phenyl 3-methylbenzoate

SMILES

Cc1cccc(C(Oc(c(/C=N/NC(CNC(c(cccc2)c2Br)=O)=O)cc(Br)c2)c2Br)=O)c1

InChI

InChI=1S/C24H18Br3N3O4/c1-14-5-4-6-15(9-14)24(33)34-22-16(10-17(25)11-20(22)27)12-29-30-21(31)13-28-23(32)18-7-2-3-8-19(18)26/h2-12H,13H2,1H3,(H,28,32)(H,30,31)

InChI Key

DBNJXPRZZFLWLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00747316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

652.14

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.419

Distribution Coefficient, logD

6.403

Water Solubility, LogSw

-5.79

Polar Surface Area

80.577

Acid Dissociation Constant (pKa)

8.82

Base Dissociation Constant (pKb)

-2.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with 8005-0803 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-0803?
Check Price and Availability of 8005-0803, 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 8005-0803 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-0803
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-0803
  • 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 8005-0803 available by request