Screening compound: JALBXGYJMRAXOA-SFHVURJKSA-N

Screening compound: JALBXGYJMRAXOA-SFHVURJKSA-N
Screening compound: JALBXGYJMRAXOA-SFHVURJKSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
JALBXGYJMRAXOA-SFHVURJKSA-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

K403-0946

Molecular Formula

C31H39N5O6S2 (C31 H39 N5 O6 S2)

Compound Name

ethyl 2-{2-[(4-cyclohexyl-5-{[(3,5-dimethoxyphenyl)formamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]propanamido}-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

IUPAC name

ethyl 2-{2-[(4-cyclohexyl-5-{[(35-dimethoxyphenyl)formamido]methyl}-4H-124-triazol-3-yl)sulfanyl]propanamido}-4H5H6H-cyclopenta[b]thiophene-3-carboxylate

SMILES

CCOC(c1c(NC(C(C)Sc2nnc(CNC(c3cc(OC)cc(OC)c3)=O)n2C2CCCCC2)=O)sc2c1CCC2)=O

InChI

InChI=1S/C31H39N5O6S2/c1-5-42-30(39)26-23-12-9-13-24(23)44-29(26)33-27(37)18(2)43-31-35-34-25(36(31)20-10-7-6-8-11-20)17-32-28(38)19-14-21(40-3)16-22(15-19)41-4/h14-16,18,20H,5-13,17H2,1-4H3,(H,32,38)(H,33,37)/t18-/m0/s1

InChI Key

JALBXGYJMRAXOA-SFHVURJKSA-N

MDL Number (MFCD)

MFCD04411317

JALBXGYJMRAXOA-SFHVURJKSA-N in Drug Discovery

Included in Screening Libraries

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

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

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

Frequently Asked Questions

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