Screening compound: XTHHTKJZTKUYKY-VWNXMTODSA-N

Screening compound: XTHHTKJZTKUYKY-VWNXMTODSA-N
Screening compound: XTHHTKJZTKUYKY-VWNXMTODSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
XTHHTKJZTKUYKY-VWNXMTODSA-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

S720-2358

Molecular Formula

C27H30N4O3 (C27 H30 N4 O3)

Compound Name

1-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-methyl-4-phenoxypyrrolidine-2-carboxamide

IUPAC name

(2S4S)-1-[1-(isoquinoline-1-carbonyl)piperidin-4-yl]-N-methyl-4-phenoxypyrrolidine-2-carboxamide

SMILES

CNC([C@H](C[C@@H](C1)Oc2ccccc2)N1C(CC1)CCN1C(c1nccc2ccccc12)=O)=O

InChI

InChI=1S/C27H30N4O3/c1-28-26(32)24-17-22(34-21-8-3-2-4-9-21)18-31(24)20-12-15-30(16-13-20)27(33)25-23-10-6-5-7-19(23)11-14-29-25/h2-11,14,20,22,24H,12-13,15-18H2,1H3,(H,28,32)/t22-,24+/m1/s1

InChI Key

XTHHTKJZTKUYKY-VWNXMTODSA-N

MDL Number (MFCD)

XTHHTKJZTKUYKY-VWNXMTODSA-N in Drug Discovery

Included in Screening Libraries

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

Natural-Product-Based Library (3730 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

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

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

Frequently Asked Questions

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