Screening compound: KSJBTVLLXPIOAA-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
KSJBTVLLXPIOAA-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

8012-6434

Molecular Formula

C27H22ClN3O2S2 (C27 H22 ClN3 O2 S2)

Compound Name

2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxy-2-pyrimidinyl)sulfanyl]-1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-1-ethanone

IUPAC name

1-{2-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3571214-hexaen-2-yl}-2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]ethan-1-one

SMILES

Oc1cc(CSc(cc2)ccc2Cl)nc(SCC(N(c2c(CC3)cccc2)c2c3cccc2)=O)n1

InChI

InChI=1S/C27H22ClN3O2S2/c28-20-11-13-22(14-12-20)34-16-21-15-25(32)30-27(29-21)35-17-26(33)31-23-7-3-1-5-18(23)9-10-19-6-2-4-8-24(19)31/h1-8,11-15H,9-10,16-17H2,(H,29,30,32)

InChI Key

KSJBTVLLXPIOAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02127899

KSJBTVLLXPIOAA-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

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

Frequently Asked Questions

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