Screening compound: BJNGATUHDWGKGN-HSDOWKARSA-N

Screening compound: BJNGATUHDWGKGN-HSDOWKARSA-N
Screening compound: BJNGATUHDWGKGN-HSDOWKARSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
BJNGATUHDWGKGN-HSDOWKARSA-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

C073-3697

Molecular Formula

C29H35ClFN3O5 (C29 H35 ClFN3 O5)

Compound Name

(1S,2R,5S,7R)-N~6~-(3-chloro-4-fluorophenyl)-N~2~-(2,3-dimethylcyclohexyl)-4-oxo-3-(tetrahydro-2-furanylmethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-2,6-dicarboxamide

IUPAC name

(5S7R)-N6-(3-chloro-4-fluorophenyl)-N2-(23-dimethylcyclohexyl)-4-oxo-3-[(oxolan-2-yl)methyl]-10-oxa-3-azatricyclo[5.2.1.0^{15}]dec-8-ene-26-dicarboxamide

SMILES

CC(CCC1)C(C)C1NC(C([C@]1([C@H]2C3C(Nc(cc4)cc(Cl)c4F)=O)O[C@H]3C=C1)N(CC1OCCC1)C2=O)=O

InChI

InChI=1S/C29H35ClFN3O5/c1-15-5-3-7-21(16(15)2)33-27(36)25-29-11-10-22(39-29)23(26(35)32-17-8-9-20(31)19(30)13-17)24(29)28(37)34(25)14-18-6-4-12-38-18/h8-11,13,15-16,18,21-25H,3-7,12,14H2,1-2H3,(H,32,35)(H,33,36)/t15?,16?,18?,21?,22-,23?,24-,25?,29-/m0/s1

InChI Key

BJNGATUHDWGKGN-HSDOWKARSA-N

MDL Number (MFCD)

BJNGATUHDWGKGN-HSDOWKARSA-N in Drug Discovery

Included in Screening Libraries

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

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

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

Frequently Asked Questions

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