Screening compound: XBNKEGBHBSCOGY-JKAWKZIYSA-N

Screening compound: XBNKEGBHBSCOGY-JKAWKZIYSA-N
Screening compound: XBNKEGBHBSCOGY-JKAWKZIYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
XBNKEGBHBSCOGY-JKAWKZIYSA-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

C073-4315

Molecular Formula

C29H37ClN4O4 (C29 H37 ClN4 O4)

Compound Name

(1R,2S,5R,7S)-N~6~-(4-chlorophenyl)-N~2~-cyclohexyl-4-oxo-3-(2-piperidinoethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-2,6-dicarboxamide

IUPAC name

(5R7S)-N6-(4-chlorophenyl)-N2-cyclohexyl-4-oxo-3-[2-(piperidin-1-yl)ethyl]-10-oxa-3-azatricyclo[5.2.1.0^{15}]dec-8-ene-26-dicarboxamide

SMILES

O=C(C([C@H]1C(N(CCN2CCCCC2)C2C(NC3CCCCC3)=O)=O)[C@H]3O[C@@]12C=C3)Nc(cc1)ccc1Cl

InChI

InChI=1S/C29H37ClN4O4/c30-19-9-11-21(12-10-19)31-26(35)23-22-13-14-29(38-22)24(23)28(37)34(18-17-33-15-5-2-6-16-33)25(29)27(36)32-20-7-3-1-4-8-20/h9-14,20,22-25H,1-8,15-18H2,(H,31,35)(H,32,36)/t22-,23?,24-,25?,29-/m0/s1

InChI Key

XBNKEGBHBSCOGY-JKAWKZIYSA-N

MDL Number (MFCD)

XBNKEGBHBSCOGY-JKAWKZIYSA-N in Drug Discovery

Included in Screening Libraries

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

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

Frequently Asked Questions

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