Screening compound: XTSMHIRXICEYQX-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
XTSMHIRXICEYQX-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

K622-0375

Molecular Formula

C31H40N4O6S (C31 H40 N4 O6 S)

Compound Name

3-({77-DIMETHYL-2-OXOBICYCLO[2.2.1]HEPTAN-1-YL}METHANESULFONAMIDO)-N-(2-METHOXYETHYL)-4-{6-OXO-711-DIAZATRICYCLO[7.3.1.0{27}]TRIDECA-24-DIEN-11-YL}BENZAMIDE

IUPAC name

3-({77-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl}methanesulfonamido)-N-(2-methoxyethyl)-4-{6-oxo-711-diazatricyclo[7.3.1.0^{27}]trideca-24-dien-11-yl}benzamide

SMILES

CC(C)(C(CC1)C2)C1(CS(Nc(cc(cc1)C(NCCOC)=O)c1N(CC(C1)CN34)CC1C4=CC=CC3=O)(=O)=O)C2=O

InChI

InChI=1S/C31H40N4O6S/c1-30(2)23-9-10-31(30,27(36)15-23)19-42(39,40)33-24-14-21(29(38)32-11-12-41-3)7-8-26(24)34-16-20-13-22(18-34)25-5-4-6-28(37)35(25)17-20/h4-8,14,20,22-23,33H,9-13,15-19H2,1-3H3,(H,32,38)

InChI Key

XTSMHIRXICEYQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02656883

XTSMHIRXICEYQX-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

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

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

Frequently Asked Questions

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