8009-4955 Screening compound: 2-(2-chlorobenzoyl)-1-(4-ethoxyphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

8009-4955 Screening compound: 2-(2-chlorobenzoyl)-1-(4-ethoxyphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
8009-4955 Screening compound: 2-(2-chlorobenzoyl)-1-(4-ethoxyphenyl)-1H,2H,3H,4H,9H-pyrido[3,4-b]indole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-4955
2-(2-chlorobenzoyl)-1-(4-ethoxyphenyl)-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

8009-4955

Molecular Formula

C26H23ClN2O2 (C26 H23 ClN2 O2)

Compound Name

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

IUPAC name

2-(2-chlorobenzoyl)-1-(4-ethoxyphenyl)-1H2H3H4H9H-pyrido[34-b]indole

SMILES

CCOc1ccc(C(c2c(CC3)c(cccc4)c4[nH]2)N3C(c(cccc2)c2Cl)=O)cc1

InChI

InChI=1S/C26H23ClN2O2/c1-2-31-18-13-11-17(12-14-18)25-24-20(19-7-4-6-10-23(19)28-24)15-16-29(25)26(30)21-8-3-5-9-22(21)27/h3-14,25,28H,2,15-16H2,1H3/t25-/m1/s1

InChI Key

UYXMAEWJDPJGRF-RUZDIDTESA-N

MDL Number (MFCD)

MFCD00851200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.93

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

5.773

Distribution Coefficient, logD

5.773

Water Solubility, LogSw

-5.90

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

19.20

8009-4955 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 8009-4955 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-4955?
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What is the minimum amount of 8009-4955 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-4955
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-4955
  • 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 8009-4955 available by request