K808-8471 Screening compound: 1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-phenylbutane-1,4-dione

K808-8471 Screening compound: 1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-phenylbutane-1,4-dione
K808-8471 Screening compound: 1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-phenylbutane-1,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound K808-8471
1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-phenylbutane-1,4-dione

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

K808-8471

Molecular Formula

C19H20N2O4 (C19 H20 N2 O4)

Compound Name

1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-phenylbutane-1,4-dione

IUPAC name

1-[4-(furan-2-carbonyl)piperazin-1-yl]-4-phenylbutane-14-dione

SMILES

O=C(CCC(N(CC1)CCN1C(c1ccco1)=O)=O)c1ccccc1

InChI

InChI=1S/C19H20N2O4/c22-16(15-5-2-1-3-6-15)8-9-18(23)20-10-12-21(13-11-20)19(24)17-7-4-14-25-17/h1-7,14H,8-13H2

InChI Key

CTYYPKUKHOMLSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15109402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.260

Distribution Coefficient, logD

1.260

Water Solubility, LogSw

-1.54

Polar Surface Area

54.641

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

-2.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

K808-8471 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with K808-8471 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K808-8471?
Check Price and Availability of K808-8471, 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 K808-8471 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K808-8471
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K808-8471
  • 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 K808-8471 available by request