Screening compound: JKMBXBUFHBWEJY-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
JKMBXBUFHBWEJY-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

L230-0086

Molecular Formula

C25H32N4O4S (C25 H32 N4 O4 S)

Compound Name

2-(1-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-(1-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)-1234-tetrahydroisoquinoline

SMILES

Cn1c(C(N2CCCC2)=O)cc(S(N(CC2)CCC2C(N(CC2)Cc3c2cccc3)=O)(=O)=O)c1

InChI

InChI=1S/C25H32N4O4S/c1-26-18-22(16-23(26)25(31)27-11-4-5-12-27)34(32,33)29-14-9-20(10-15-29)24(30)28-13-8-19-6-2-3-7-21(19)17-28/h2-3,6-7,16,18,20H,4-5,8-15,17H2,1H3

InChI Key

JKMBXBUFHBWEJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27237074

JKMBXBUFHBWEJY-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

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

Frequently Asked Questions

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