Screening compound: XKLYHGIIZXRFMJ-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
XKLYHGIIZXRFMJ-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

S723-0762

Molecular Formula

C27H27N3O4 (C27 H27 N3 O4)

Compound Name

3-{2-oxo-2-[4-({4-[(pyridin-4-yloxy)methyl]phenyl}methyl)piperidin-1-yl]ethyl}-2,3-dihydro-1,3-benzoxazol-2-one

IUPAC name

3-{2-oxo-2-[4-({4-[(pyridin-4-yloxy)methyl]phenyl}methyl)piperidin-1-yl]ethyl}-23-dihydro-13-benzoxazol-2-one

SMILES

O=C(CN(c(cccc1)c1O1)C1=O)N1CCC(Cc2ccc(COc3ccncc3)cc2)CC1

InChI

InChI=1S/C27H27N3O4/c31-26(18-30-24-3-1-2-4-25(24)34-27(30)32)29-15-11-21(12-16-29)17-20-5-7-22(8-6-20)19-33-23-9-13-28-14-10-23/h1-10,13-14,21H,11-12,15-19H2

InChI Key

XKLYHGIIZXRFMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31987968

XKLYHGIIZXRFMJ-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Phosphatases

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

Frequently Asked Questions

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