G211-0021 Screening compound: N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-carboxamide

G211-0021 Screening compound: N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-carboxamide
G211-0021 Screening compound: N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G211-0021
N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-carboxamide

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

G211-0021

Molecular Formula

C24H21ClFN3O2 (C24 H21 ClFN3 O2)

Compound Name

N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-carboxamide

IUPAC name

N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-oxo-1H2H3H-pyrrolo[34-b]quinoline-9-carboxamide

SMILES

O=C(c1c(CN(C2CCCCC2)C2=O)c2nc2ccccc12)Nc(ccc(F)c1)c1Cl

InChI

InChI=1S/C24H21ClFN3O2/c25-18-12-14(26)10-11-20(18)28-23(30)21-16-8-4-5-9-19(16)27-22-17(21)13-29(24(22)31)15-6-2-1-3-7-15/h4-5,8-12,15H,1-3,6-7,13H2,(H,28,30)

InChI Key

CMRXDUDISGOHIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14986653

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.449

Distribution Coefficient, logD

4.911

Water Solubility, LogSw

-6.27

Polar Surface Area

47.857

Acid Dissociation Constant (pKa)

7.01

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

G211-0021 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G211-0021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G211-0021?
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What is the minimum amount of G211-0021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G211-0021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G211-0021
  • 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 G211-0021 available by request