Screening compound: LXCBAGKGWZQIAG-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
LXCBAGKGWZQIAG-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

C917-0197

Molecular Formula

C22H25NO5S (C22 H25 NO5 S)

Compound Name

12-[(4-isopropylphenyl)sulfonyl]-4-methoxy-9-methyl-8-oxa-10-azatricyclo[7.3.1.0~2,7~]trideca-2,4,6-trien-11-one

IUPAC name

4-methoxy-9-methyl-12-[4-(propan-2-yl)benzenesulfonyl]-8-oxa-10-azatricyclo[7.3.1.0^{27}]trideca-246-trien-11-one

SMILES

CC(C)c(cc1)ccc1S(C(C(C1)c(cc(cc2)OC)c2OC1(C)N1)C1=O)(=O)=O

InChI

InChI=1S/C22H25NO5S/c1-13(2)14-5-8-16(9-6-14)29(25,26)20-18-12-22(3,23-21(20)24)28-19-10-7-15(27-4)11-17(18)19/h5-11,13,18,20H,12H2,1-4H3,(H,23,24)

InChI Key

LXCBAGKGWZQIAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06745158

LXCBAGKGWZQIAG-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

DGK Inhibitors Library (10558 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

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

Frequently Asked Questions

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