Screening compound: XGSVKBZRNHODRV-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
XGSVKBZRNHODRV-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

4663-2462

Molecular Formula

C27H22BrN3O3 (C27 H22 BrN3 O3)

Compound Name

1-allyl-9'-bromo-2'-(4-methoxyphenyl)-1',10b'-dihydrospiro[indole-3,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2(1H)-one

IUPAC name

12'-bromo-4'-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-12-dihydro-8'-oxa-5'6'-diazaspiro[indole-37'-tricyclo[7.4.0.0^{26}]tridecane]-1'(9')4'10'12'-tetraen-2-one

SMILES

COc(cc1)ccc1C(CC12)=NN1C(c(cccc1)c1N1CC=C)(C1=O)Oc(cc1)c2cc1Br

InChI

InChI=1S/C27H22BrN3O3/c1-3-14-30-23-7-5-4-6-21(23)27(26(30)32)31-24(20-15-18(28)10-13-25(20)34-27)16-22(29-31)17-8-11-19(33-2)12-9-17/h3-13,15,24H,1,14,16H2,2H3

InChI Key

XGSVKBZRNHODRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03040312

XGSVKBZRNHODRV-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral HBV Library (10007 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

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

Frequently Asked Questions

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