F681-0065 Screening compound: 1-benzyl-3-[3-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-1,2-dihydroquinoxalin-2-one

F681-0065 Screening compound: 1-benzyl-3-[3-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-1,2-dihydroquinoxalin-2-one
F681-0065 Screening compound: 1-benzyl-3-[3-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-1,2-dihydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F681-0065
1-benzyl-3-[3-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-1,2-dihydroquinoxalin-2-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

F681-0065

Molecular Formula

C28H35N5O2 (C28 H35 N5 O2)

Compound Name

1-benzyl-3-[3-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-1,2-dihydroquinoxalin-2-one

IUPAC name

1-benzyl-3-[3-(4-propylpiperazine-1-carbonyl)piperidin-1-yl]-12-dihydroquinoxalin-2-one

SMILES

CCCN(CC1)CCN1C(C(CCC1)CN1C1=Nc(cccc2)c2N(Cc2ccccc2)C1=O)=O

InChI

InChI=1S/C28H35N5O2/c1-2-14-30-16-18-31(19-17-30)27(34)23-11-8-15-32(21-23)26-28(35)33(20-22-9-4-3-5-10-22)25-13-7-6-12-24(25)29-26/h3-7,9-10,12-13,23H,2,8,11,14-21H2,1H3/t23-/m0/s1

InChI Key

AKLOTIGCMWEHMB-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD27184252

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.173

Distribution Coefficient, logD

2.722

Water Solubility, LogSw

-3.26

Polar Surface Area

46.592

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

7.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.40

F681-0065 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F681-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F681-0065?
Check Price and Availability of F681-0065, 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 F681-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F681-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F681-0065
  • 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 F681-0065 available by request