8008-8283 Screening compound: ethyl 5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate

8008-8283 Screening compound: ethyl 5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate
8008-8283 Screening compound: ethyl 5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-8283
ethyl 5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate

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

8008-8283

Molecular Formula

C24H28N2O4 (C24 H28 N2 O4)

Compound Name

ethyl 5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate

IUPAC name

ethyl 5-methoxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-benzofuran-3-carboxylate

SMILES

CCOC(c1c(CN(CC2)CCN2c2c(C)cccc2)oc(cc2)c1cc2OC)=O

InChI

InChI=1S/C24H28N2O4/c1-4-29-24(27)23-19-15-18(28-3)9-10-21(19)30-22(23)16-25-11-13-26(14-12-25)20-8-6-5-7-17(20)2/h5-10,15H,4,11-14,16H2,1-3H3

InChI Key

XPSMLKHTQKJUAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460113

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

408.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.643

Distribution Coefficient, logD

3.337

Water Solubility, LogSw

-4.48

Polar Surface Area

42.924

Acid Dissociation Constant (pKa)

27.97

Base Dissociation Constant (pKb)

8.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

8008-8283 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with 8008-8283 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-8283?
Check Price and Availability of 8008-8283, 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 8008-8283 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-8283
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-8283
  • 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 8008-8283 available by request