Screening compound: KKKAYPSGXJRATR-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
KKKAYPSGXJRATR-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

K286-0262

Molecular Formula

C27H20ClN5O3S3 (C27 H20 ClN5 O3 S3)

Compound Name

5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-6-[(furan-2-yl)methyl]-3-(2-phenylethyl)-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

IUPAC name

5-[({7-chloro-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)sulfanyl]-6-[(furan-2-yl)methyl]-3-(2-phenylethyl)-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

O=C1N(C=C(C=C2)Cl)C2=NC(CSC(N(Cc2ccco2)C2=O)=NC(N3CCc4ccccc4)=C2SC3=S)=C1

InChI

InChI=1S/C27H20ClN5O3S3/c28-18-8-9-21-29-19(13-22(34)32(21)14-18)16-38-26-30-24-23(25(35)33(26)15-20-7-4-12-36-20)39-27(37)31(24)11-10-17-5-2-1-3-6-17/h1-9,12-14H,10-11,15-16H2

InChI Key

KKKAYPSGXJRATR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024641

KKKAYPSGXJRATR-UHFFFAOYSA-N 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 KKKAYPSGXJRATR-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound KKKAYPSGXJRATR-UHFFFAOYSA-N?
Check Price and Availability of KKKAYPSGXJRATR-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 KKKAYPSGXJRATR-UHFFFAOYSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for KKKAYPSGXJRATR-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 KKKAYPSGXJRATR-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 KKKAYPSGXJRATR-UHFFFAOYSA-N available by request