K034-0088 Screening compound: 4-[4-(furan-2-carbonyl)piperazin-1-yl]-7-nitro-2,1,3-benzoxadiazole

K034-0088 Screening compound: 4-[4-(furan-2-carbonyl)piperazin-1-yl]-7-nitro-2,1,3-benzoxadiazole
K034-0088 Screening compound: 4-[4-(furan-2-carbonyl)piperazin-1-yl]-7-nitro-2,1,3-benzoxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound K034-0088
4-[4-(furan-2-carbonyl)piperazin-1-yl]-7-nitro-2,1,3-benzoxadiazole

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

K034-0088

Molecular Formula

C15H13N5O5 (C15 H13 N5 O5)

Compound Name

4-[4-(furan-2-carbonyl)piperazin-1-yl]-7-nitro-2,1,3-benzoxadiazole

IUPAC name

4-[4-(furan-2-carbonyl)piperazin-1-yl]-7-nitro-213-benzoxadiazole

SMILES

[O-][N+](c(c1nonc11)ccc1N(CC1)CCN1C(c1ccco1)=O)=O

InChI

InChI=1S/C15H13N5O5/c21-15(12-2-1-9-24-12)19-7-5-18(6-8-19)10-3-4-11(20(22)23)14-13(10)16-25-17-14/h1-4,9H,5-8H2

InChI Key

RBDCRILFWXVATD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01533388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.3

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.038

Distribution Coefficient, logD

2.038

Water Solubility, LogSw

-2.17

Polar Surface Area

98.365

Acid Dissociation Constant (pKa)

26.73

Base Dissociation Constant (pKb)

-2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

K034-0088 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K034-0088 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K034-0088?
Check Price and Availability of K034-0088, 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 K034-0088 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K034-0088
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K034-0088
  • 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 K034-0088 available by request