F541-0586 Screening compound: 6-[5-(1-CYCLOPENTYL-5-OXOTETRAHYDRO-1H-PYRROL-3-YL)-1,2,4-OXADIAZOL-3-YL]-3-METHYL-1-PROPYL-2(1H)-QUINOXALINONE

F541-0586 Screening compound: 6-[5-(1-CYCLOPENTYL-5-OXOTETRAHYDRO-1H-PYRROL-3-YL)-1,2,4-OXADIAZOL-3-YL]-3-METHYL-1-PROPYL-2(1H)-QUINOXALINONE
F541-0586 Screening compound: 6-[5-(1-CYCLOPENTYL-5-OXOTETRAHYDRO-1H-PYRROL-3-YL)-1,2,4-OXADIAZOL-3-YL]-3-METHYL-1-PROPYL-2(1H)-QUINOXALINONE alternative view

Chemical Structure Depiction of ChemDiv screening compound F541-0586
6-[5-(1-CYCLOPENTYL-5-OXOTETRAHYDRO-1H-PYRROL-3-YL)-1,2,4-OXADIAZOL-3-YL]-3-METHYL-1-PROPYL-2(1H)-QUINOXALINONE

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

F541-0586

Molecular Formula

C23H27N5O3 (C23 H27 N5 O3)

Compound Name

6-[5-(1-CYCLOPENTYL-5-OXOTETRAHYDRO-1H-PYRROL-3-YL)-1,2,4-OXADIAZOL-3-YL]-3-METHYL-1-PROPYL-2(1H)-QUINOXALINONE

IUPAC name

n/a

SMILES

CCCN(c(ccc(-c1noc(C(C2)CN(C3CCCC3)C2=O)n1)c1)c1N=C1C)C1=O

InChI

InChI=1S/C23H27N5O3/c1-3-10-27-19-9-8-15(11-18(19)24-14(2)23(27)30)21-25-22(31-26-21)16-12-20(29)28(13-16)17-6-4-5-7-17/h8-9,11,16-17H,3-7,10,12-13H2,1-2H3/t16-/m0/s1

InChI Key

AZIGPVLALWHIQL-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27174604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.720

Distribution Coefficient, logD

3.720

Water Solubility, LogSw

-4.00

Polar Surface Area

71.228

Acid Dissociation Constant (pKa)

14.82

Base Dissociation Constant (pKb)

-0.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.20

F541-0586 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F541-0586 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F541-0586?
Check Price and Availability of F541-0586, 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 F541-0586 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F541-0586
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F541-0586
  • 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 F541-0586 available by request