F862-0243 Screening compound: methyl 2,4-dimethyl-5-[4-({[(5-methylfuran-2-yl)methyl]carbamoyl}methyl)piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate

F862-0243 Screening compound: methyl 2,4-dimethyl-5-[4-({[(5-methylfuran-2-yl)methyl]carbamoyl}methyl)piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate
F862-0243 Screening compound: methyl 2,4-dimethyl-5-[4-({[(5-methylfuran-2-yl)methyl]carbamoyl}methyl)piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F862-0243
methyl 2,4-dimethyl-5-[4-({[(5-methylfuran-2-yl)methyl]carbamoyl}methyl)piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate

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

F862-0243

Molecular Formula

C22H29N3O5 (C22 H29 N3 O5)

Compound Name

methyl 2,4-dimethyl-5-[4-({[(5-methylfuran-2-yl)methyl]carbamoyl}methyl)piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate

IUPAC name

methyl 24-dimethyl-5-[4-({[(5-methylfuran-2-yl)methyl]carbamoyl}methyl)piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate

SMILES

Cc1ccc(CNC(CC(CC2)CCN2C(c2c(C)c(C(OC)=O)c(C)[nH]2)=O)=O)o1

InChI

InChI=1S/C22H29N3O5/c1-13-5-6-17(30-13)12-23-18(26)11-16-7-9-25(10-8-16)21(27)20-14(2)19(15(3)24-20)22(28)29-4/h5-6,16,24H,7-12H2,1-4H3,(H,23,26)

InChI Key

NWEMUYHBZOXAAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27200300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.627

Distribution Coefficient, logD

2.627

Water Solubility, LogSw

-2.84

Polar Surface Area

80.505

Acid Dissociation Constant (pKa)

12.64

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

F862-0243 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

KRAS-Targeted Library (16000 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F862-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F862-0243?
Check Price and Availability of F862-0243, 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 F862-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F862-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F862-0243
  • 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 F862-0243 available by request