G811-1189 Screening compound: 1-(3-ethoxyphenyl)-2-(3-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

G811-1189 Screening compound: 1-(3-ethoxyphenyl)-2-(3-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
G811-1189 Screening compound: 1-(3-ethoxyphenyl)-2-(3-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound G811-1189
1-(3-ethoxyphenyl)-2-(3-methylbenzoyl)-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

G811-1189

Molecular Formula

C27H26N2O2 (C27 H26 N2 O2)

Compound Name

1-(3-ethoxyphenyl)-2-(3-methylbenzoyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

IUPAC name

1-(3-ethoxyphenyl)-2-(3-methylbenzoyl)-1H2H3H4H9H-pyrido[34-b]indole

SMILES

CCOc1cccc(C(c2c(CC3)c(cccc4)c4[nH]2)N3C(c2cc(C)ccc2)=O)c1

InChI

InChI=1S/C27H26N2O2/c1-3-31-21-11-7-9-19(17-21)26-25-23(22-12-4-5-13-24(22)28-25)14-15-29(26)27(30)20-10-6-8-18(2)16-20/h4-13,16-17,26,28H,3,14-15H2,1-2H3/t26-/m1/s1

InChI Key

XFCZMDMZEJRAFR-AREMUKBSSA-N

MDL Number (MFCD)

MFCD15038355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.52

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.771

Distribution Coefficient, logD

5.771

Water Solubility, LogSw

-5.77

Polar Surface Area

33.195

Acid Dissociation Constant (pKa)

18.36

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

G811-1189 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G811-1189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G811-1189?
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What is the minimum amount of G811-1189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G811-1189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G811-1189
  • 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 G811-1189 available by request