8008-2527 Screening compound: 1-(4-bromophenyl)-3-{[[(4-chlorobenzyl)amino](phenylimino)methyl]sulfanyl}-2,5-dioxopyrrolidine

8008-2527 Screening compound: 1-(4-bromophenyl)-3-{[[(4-chlorobenzyl)amino](phenylimino)methyl]sulfanyl}-2,5-dioxopyrrolidine
8008-2527 Screening compound: 1-(4-bromophenyl)-3-{[[(4-chlorobenzyl)amino](phenylimino)methyl]sulfanyl}-2,5-dioxopyrrolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-2527
1-(4-bromophenyl)-3-{[[(4-chlorobenzyl)amino](phenylimino)methyl]sulfanyl}-2,5-dioxopyrrolidine

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

8008-2527

Molecular Formula

C24H19BrClN3O2S (C24 H19 BrClN3 O2 S)

Compound Name

1-(4-bromophenyl)-3-{[[(4-chlorobenzyl)amino](phenylimino)methyl]sulfanyl}-2,5-dioxopyrrolidine

IUPAC name

(E)-1-{[1-(4-bromophenyl)-25-dioxopyrrolidin-3-yl]sulfanyl}-N-[(4-chlorophenyl)methyl]-N'-phenylmethanimidamide

SMILES

O=C(CC(C1=O)S/C(/NCc(cc2)ccc2Cl)=N/c2ccccc2)N1c(cc1)ccc1Br

InChI

InChI=1S/C24H19BrClN3O2S/c25-17-8-12-20(13-9-17)29-22(30)14-21(23(29)31)32-24(28-19-4-2-1-3-5-19)27-15-16-6-10-18(26)11-7-16/h1-13,21H,14-15H2,(H,27,28)/t21-/m1/s1

InChI Key

LDJPPDHTSQGPSG-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD01239965

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.907

Distribution Coefficient, logD

4.902

Water Solubility, LogSw

-5.05

Polar Surface Area

47.768

Acid Dissociation Constant (pKa)

13.39

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 8008-2527 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-2527?
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What is the minimum amount of 8008-2527 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-2527
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-2527
  • 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 8008-2527 available by request