Screening compound: YKMRTSOPINPUDA-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
YKMRTSOPINPUDA-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

C530-1273

Molecular Formula

C29H27FN2O4S (C29 H27 FN2 O4 S)

Compound Name

N~8~-[2-(1-cyclohexenyl)ethyl]-10-(4-fluorobenzyl)-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-9-[(4-fluorophenyl)methyl]-2210-trioxo-2lambda6-thia-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaene-6-carboxamide

SMILES

O=C(c(cc1)cc(N(Cc(cc2)ccc2F)C(c2c3cccc2)=O)c1S3(=O)=O)NCCC1=CCCCC1

InChI

InChI=1S/C29H27FN2O4S/c30-23-13-10-21(11-14-23)19-32-25-18-22(28(33)31-17-16-20-6-2-1-3-7-20)12-15-27(25)37(35,36)26-9-5-4-8-24(26)29(32)34/h4-6,8-15,18H,1-3,7,16-17,19H2,(H,31,33)

InChI Key

YKMRTSOPINPUDA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14767934

YKMRTSOPINPUDA-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Antiviral Annotated Library (21441 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Recognition Elements PPI Library (24135 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • PPI modulators
  • PPI modulators

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

Frequently Asked Questions

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