Screening compound: KKNUHPDKKOXCCS-UHFFFAOYSA-N

Screening compound: KKNUHPDKKOXCCS-UHFFFAOYSA-N
Screening compound: KKNUHPDKKOXCCS-UHFFFAOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
KKNUHPDKKOXCCS-UHFFFAOYSA-N

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

V020-3336

Molecular Formula

C31H35N5O3 (C31 H35 N5 O3)

Compound Name

cyclopentyl{4-[6-isobutyl-3-(3-phenoxyphenyl)isoxazolo[5,4-d]pyrimidin-4-yl]piperazino}methanone

IUPAC name

1-cyclopentanecarbonyl-4-[6-(2-methylpropyl)-3-(3-phenoxyphenyl)-[12]oxazolo[54-d]pyrimidin-4-yl]piperazine

SMILES

CC(C)Cc1nc(onc2-c3cc(Oc4ccccc4)ccc3)c2c(N(CC2)CCN2C(C2CCCC2)=O)n1

InChI

InChI=1S/C31H35N5O3/c1-21(2)19-26-32-29(35-15-17-36(18-16-35)31(37)22-9-6-7-10-22)27-28(34-39-30(27)33-26)23-11-8-14-25(20-23)38-24-12-4-3-5-13-24/h3-5,8,11-14,20-22H,6-7,9-10,15-19H2,1-2H3

InChI Key

KKNUHPDKKOXCCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19937415

KKNUHPDKKOXCCS-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

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

Frequently Asked Questions

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