L708-1996 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-[6-(3,4-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide

L708-1996 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-[6-(3,4-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
L708-1996 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-[6-(3,4-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L708-1996
N-[2-(4-chlorophenyl)ethyl]-2-[6-(3,4-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide

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

L708-1996

Molecular Formula

C23H22ClN3O3S (C23 H22 ClN3 O3 S)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-2-[6-(3,4-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-2-[6-(34-dimethoxyphenyl)imidazo[21-b][13]thiazol-3-yl]acetamide

SMILES

COc(ccc(-c1cn(c(CC(NCCc(cc2)ccc2Cl)=O)cs2)c2n1)c1)c1OC

InChI

InChI=1S/C23H22ClN3O3S/c1-29-20-8-5-16(11-21(20)30-2)19-13-27-18(14-31-23(27)26-19)12-22(28)25-10-9-15-3-6-17(24)7-4-15/h3-8,11,13-14H,9-10,12H2,1-2H3,(H,25,28)

InChI Key

OJSPTXUOICIBDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27472265

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.834

Distribution Coefficient, logD

3.829

Water Solubility, LogSw

-4.50

Polar Surface Area

48.479

Acid Dissociation Constant (pKa)

14.37

Base Dissociation Constant (pKb)

5.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

L708-1996 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
  • Cancer
Targets:
  • Others
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L708-1996 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L708-1996?
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What is the minimum amount of L708-1996 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L708-1996
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L708-1996
  • 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 L708-1996 available by request