Screening compound: XYTIJBNUEXMJMS-ZWKOTPCHSA-N

Screening compound: XYTIJBNUEXMJMS-ZWKOTPCHSA-N
Screening compound: XYTIJBNUEXMJMS-ZWKOTPCHSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
XYTIJBNUEXMJMS-ZWKOTPCHSA-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

SB66-0255

Molecular Formula

C21H24N2O2S (C21 H24 N2 O2 S)

Compound Name

(5aR,8aR)-1-benzyl-7-[(5-methyl-2-thienyl)carbonyl]octahydropyrrolo[3,4-b]azepin-2(1H)-one

IUPAC name

(5aR8aR)-1-benzyl-7-(5-methylthiophene-2-carbonyl)-decahydropyrrolo[34-b]azepin-2-one

SMILES

Cc1ccc(C(N(C[C@H]2CCC3)C[C@@H]2N(Cc2ccccc2)C3=O)=O)s1

InChI

InChI=1S/C21H24N2O2S/c1-15-10-11-19(26-15)21(25)22-13-17-8-5-9-20(24)23(18(17)14-22)12-16-6-3-2-4-7-16/h2-4,6-7,10-11,17-18H,5,8-9,12-14H2,1H3/t17-,18+/m0/s1

InChI Key

XYTIJBNUEXMJMS-ZWKOTPCHSA-N

MDL Number (MFCD)

XYTIJBNUEXMJMS-ZWKOTPCHSA-N in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

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

Frequently Asked Questions

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