8004-1453 Screening compound: 2-[4-(benzoylamino)phenyl]-2-oxoethyl 2,4-dichlorobenzoate

8004-1453 Screening compound: 2-[4-(benzoylamino)phenyl]-2-oxoethyl 2,4-dichlorobenzoate
8004-1453 Screening compound: 2-[4-(benzoylamino)phenyl]-2-oxoethyl 2,4-dichlorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-1453
2-[4-(benzoylamino)phenyl]-2-oxoethyl 2,4-dichlorobenzoate

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

8004-1453

Molecular Formula

C22H15Cl2NO4 (C22 H15 Cl2 NO4)

Compound Name

2-[4-(benzoylamino)phenyl]-2-oxoethyl 2,4-dichlorobenzoate

IUPAC name

2-(4-benzamidophenyl)-2-oxoethyl 24-dichlorobenzoate

SMILES

O=C(COC(c(ccc(Cl)c1)c1Cl)=O)c(cc1)ccc1NC(c1ccccc1)=O

InChI

InChI=1S/C22H15Cl2NO4/c23-16-8-11-18(19(24)12-16)22(28)29-13-20(26)14-6-9-17(10-7-14)25-21(27)15-4-2-1-3-5-15/h1-12H,13H2,(H,25,27)

InChI Key

BHKQWRWPMLHCRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00342528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.054

Distribution Coefficient, logD

5.045

Water Solubility, LogSw

-5.30

Polar Surface Area

57.434

Acid Dissociation Constant (pKa)

9.12

Base Dissociation Constant (pKb)

-3.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.55

References: we are preparing a list of scientific research reports with 8004-1453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-1453?
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What is the minimum amount of 8004-1453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-1453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-1453
  • 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 8004-1453 available by request