Screening compound: XTIFFGUOYBLSOS-PUPFEQFDSA-N

Screening compound: XTIFFGUOYBLSOS-PUPFEQFDSA-N
Screening compound: XTIFFGUOYBLSOS-PUPFEQFDSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
XTIFFGUOYBLSOS-PUPFEQFDSA-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

N121-0965

Molecular Formula

C31H39N5O2 (C31 H39 N5 O2)

Compound Name

4-[(1R,3aS,10aS,10bS)-2-benzoyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N~1~-[2-(1H-1,3-benzimidazol-2-yl)ethyl]butanamide

IUPAC name

4-[(5R6R9S13S)-7-benzoyl-17-diazatricyclo[7.3.1.0^{513}]tridecan-6-yl]-N-[2-(1H-13-benzodiazol-2-yl)ethyl]butanamide

SMILES

O=C(CCC[C@H]([C@@H]1[C@H]([C@@H](CCC2)C3)N2CCC1)N3C(c1ccccc1)=O)NCCc1nc(cccc2)c2[nH]1

InChI

InChI=1S/C31H39N5O2/c37-29(32-18-17-28-33-25-13-4-5-14-26(25)34-28)16-6-15-27-24-12-8-20-35-19-7-11-23(30(24)35)21-36(27)31(38)22-9-2-1-3-10-22/h1-5,9-10,13-14,23-24,27,30H,6-8,11-12,15-21H2,(H,32,37)(H,33,34)/t23-,24-,27-,30-/m1/s1

InChI Key

XTIFFGUOYBLSOS-PUPFEQFDSA-N

MDL Number (MFCD)

XTIFFGUOYBLSOS-PUPFEQFDSA-N in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

CORONAVIRUS Library (20774 compounds)

Natural-Product-Based Library (3730 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Structure:
  • 3D
  • Pool
  • Mimetics
Mechanism of action:
  • PPI modulators
Targets:
  • Phosphatases

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

Frequently Asked Questions

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