Screening compound: JDIBNGIUEFTULJ-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
JDIBNGIUEFTULJ-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

K788-8341

Molecular Formula

C29H28ClN3O5S (C29 H28 ClN3 O5 S)

Compound Name

ethyl 4-({[10-(3-chlorobenzyl)-5,11-dioxo-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepin-8-yl]carbonyl}amino)tetrahydro-1(2H)-pyridinecarboxylate

IUPAC name

ethyl 4-{9-[(3-chlorophenyl)methyl]-210-dioxo-2lambda4-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(15)3(8)461113-hexaene-6-amido}piperidine-1-carboxylate

SMILES

CCOC(N(CC1)CCC1NC(c(cc1)cc(N(Cc2cccc(Cl)c2)C(c2c3cccc2)=O)c1S3=O)=O)=O

InChI

InChI=1S/C29H30ClN3O5S/c1-2-38-29(36)32-14-12-22(13-15-32)31-27(34)20-10-11-26-24(17-20)33(18-19-6-5-7-21(30)16-19)28(35)23-8-3-4-9-25(23)39(26)37/h3-11,16-17,22H,2,12-15,18,39H2,1H3,(H,31,34)

InChI Key

JDIBNGIUEFTULJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15107698

JDIBNGIUEFTULJ-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Receptor's ligands
Structure:
  • Cyclic compounds
Targets:
  • GPCR

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

Frequently Asked Questions

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