L588-0228 Screening compound: 5-methoxy-2-[4-(3,4,5-triethoxybenzoyl)piperazine-1-carbonyl]-1H-indole

L588-0228 Screening compound: 5-methoxy-2-[4-(3,4,5-triethoxybenzoyl)piperazine-1-carbonyl]-1H-indole
L588-0228 Screening compound: 5-methoxy-2-[4-(3,4,5-triethoxybenzoyl)piperazine-1-carbonyl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound L588-0228
5-methoxy-2-[4-(3,4,5-triethoxybenzoyl)piperazine-1-carbonyl]-1H-indole

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

L588-0228

Molecular Formula

C27H33N3O6 (C27 H33 N3 O6)

Compound Name

5-methoxy-2-[4-(3,4,5-triethoxybenzoyl)piperazine-1-carbonyl]-1H-indole

IUPAC name

5-methoxy-2-[4-(345-triethoxybenzoyl)piperazine-1-carbonyl]-1H-indole

SMILES

CCOc1cc(C(N(CC2)CCN2C(c2cc(cc(cc3)OC)c3[nH]2)=O)=O)cc(OCC)c1OCC

InChI

InChI=1S/C27H33N3O6/c1-5-34-23-16-19(17-24(35-6-2)25(23)36-7-3)26(31)29-10-12-30(13-11-29)27(32)22-15-18-14-20(33-4)8-9-21(18)28-22/h8-9,14-17,28H,5-7,10-13H2,1-4H3

InChI Key

KALYRTIQUAGKCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27463995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.435

Distribution Coefficient, logD

3.435

Water Solubility, LogSw

-3.62

Polar Surface Area

71.953

Acid Dissociation Constant (pKa)

15.10

Base Dissociation Constant (pKb)

-3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

L588-0228 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • Mimetics
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L588-0228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L588-0228?
Check Price and Availability of L588-0228, 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 L588-0228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L588-0228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L588-0228
  • 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 L588-0228 available by request