G211-0242 Screening compound: 2-cyclohexyl-9-(3-phenylpyrrolidine-1-carbonyl)-1H,2H,3H-pyrrolo[3,4-b]quinolin-3-one

G211-0242 Screening compound: 2-cyclohexyl-9-(3-phenylpyrrolidine-1-carbonyl)-1H,2H,3H-pyrrolo[3,4-b]quinolin-3-one
G211-0242 Screening compound: 2-cyclohexyl-9-(3-phenylpyrrolidine-1-carbonyl)-1H,2H,3H-pyrrolo[3,4-b]quinolin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G211-0242
2-cyclohexyl-9-(3-phenylpyrrolidine-1-carbonyl)-1H,2H,3H-pyrrolo[3,4-b]quinolin-3-one

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

G211-0242

Molecular Formula

C28H29N3O2 (C28 H29 N3 O2)

Compound Name

2-cyclohexyl-9-(3-phenylpyrrolidine-1-carbonyl)-1H,2H,3H-pyrrolo[3,4-b]quinolin-3-one

IUPAC name

2-cyclohexyl-9-(3-phenylpyrrolidine-1-carbonyl)-1H2H3H-pyrrolo[34-b]quinolin-3-one

SMILES

O=C(c1c(CN(C2CCCCC2)C2=O)c2nc2ccccc12)N(CC1)CC1c1ccccc1

InChI

InChI=1S/C28H29N3O2/c32-27(30-16-15-20(17-30)19-9-3-1-4-10-19)25-22-13-7-8-14-24(22)29-26-23(25)18-31(28(26)33)21-11-5-2-6-12-21/h1,3-4,7-10,13-14,20-21H,2,5-6,11-12,15-18H2/t20-/m1/s1

InChI Key

DYBGEMMGHSQMOD-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD27210920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.328

Distribution Coefficient, logD

5.328

Water Solubility, LogSw

-5.79

Polar Surface Area

42.140

Acid Dissociation Constant (pKa)

17.38

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.30

G211-0242 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

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

GABA Library (7115 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Eye
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G211-0242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G211-0242?
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What is the minimum amount of G211-0242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G211-0242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G211-0242
  • 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 G211-0242 available by request