G811-0051 Screening compound: 1-phenyl-2-(3,4,5-triethoxybenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

G811-0051 Screening compound: 1-phenyl-2-(3,4,5-triethoxybenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
G811-0051 Screening compound: 1-phenyl-2-(3,4,5-triethoxybenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound G811-0051
1-phenyl-2-(3,4,5-triethoxybenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]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

G811-0051

Molecular Formula

C30H32N2O4 (C30 H32 N2 O4)

Compound Name

1-phenyl-2-(3,4,5-triethoxybenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

IUPAC name

1-phenyl-2-(345-triethoxybenzoyl)-1H2H3H4H9H-pyrido[34-b]indole

SMILES

CCOc1cc(C(N(CCc2c3[nH]c4c2cccc4)C3c2ccccc2)=O)cc(OCC)c1OCC

InChI

InChI=1S/C30H32N2O4/c1-4-34-25-18-21(19-26(35-5-2)29(25)36-6-3)30(33)32-17-16-23-22-14-10-11-15-24(22)31-27(23)28(32)20-12-8-7-9-13-20/h7-15,18-19,28,31H,4-6,16-17H2,1-3H3/t28-/m1/s1

InChI Key

ILCPARXEUVXDKP-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD15038292

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.6

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

5.755

Distribution Coefficient, logD

5.755

Water Solubility, LogSw

-5.82

Polar Surface Area

47.789

Acid Dissociation Constant (pKa)

18.36

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

G811-0051 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G811-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G811-0051?
Check Price and Availability of G811-0051, 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 G811-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G811-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G811-0051
  • 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 G811-0051 available by request