G211-0286 Screening compound: methyl 4-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}benzoate

G211-0286 Screening compound: methyl 4-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}benzoate
G211-0286 Screening compound: methyl 4-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G211-0286
methyl 4-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}benzoate

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

G211-0286

Molecular Formula

C26H25N3O4 (C26 H25 N3 O4)

Compound Name

methyl 4-{2-cyclohexyl-3-oxo-1H,2H,3H-pyrrolo[3,4-b]quinoline-9-amido}benzoate

IUPAC name

methyl 4-{2-cyclohexyl-3-oxo-1H2H3H-pyrrolo[34-b]quinoline-9-amido}benzoate

SMILES

COC(c(cc1)ccc1NC(c1c(CN(C2CCCCC2)C2=O)c2nc2ccccc12)=O)=O

InChI

InChI=1S/C26H25N3O4/c1-33-26(32)16-11-13-17(14-12-16)27-24(30)22-19-9-5-6-10-21(19)28-23-20(22)15-29(25(23)31)18-7-3-2-4-8-18/h5-6,9-14,18H,2-4,7-8,15H2,1H3,(H,27,30)

InChI Key

RYPKRDXAQHOWMM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27210931

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.908

Distribution Coefficient, logD

4.897

Water Solubility, LogSw

-5.02

Polar Surface Area

69.729

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

G211-0286 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Lipid Metabolism Library (9174 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Metabolic
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G211-0286 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G211-0286?
Check Price and Availability of G211-0286, 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 G211-0286 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G211-0286
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G211-0286
  • 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 G211-0286 available by request