Screening compound: MFCD04004550

Screening compound: MFCD04004550
Screening compound: MFCD04004550 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD04004550

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

D733-0718

Molecular Formula

C22H27N3O2S (C22 H27 N3 O2 S)

Compound Name

1-isopropyl-7'-methoxy-2'-(2-thienyl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

IUPAC name

10'-methoxy-1-(propan-2-yl)-4'-(thiophen-2-yl)-8'-oxa-5'6'-diazaspiro[piperidine-47'-tricyclo[7.4.0.0^{26}]tridecane]-1'(9')4'10'12'-tetraene

SMILES

CC(C)N(CC1)CCC1(N(C1C2)N=C2c2cccs2)Oc2c1cccc2OC

InChI

InChI=1S/C22H27N3O2S/c1-15(2)24-11-9-22(10-12-24)25-18(14-17(23-25)20-8-5-13-28-20)16-6-4-7-19(26-3)21(16)27-22/h4-8,13,15,18H,9-12,14H2,1-3H3/t18-/m1/s1

InChI Key

VLVMKDUFEQPIAC-GOSISDBHSA-N

MDL Number (MFCD)

MFCD04004550

MFCD04004550 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Anti-HIV1 Library (19540 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 MFCD04004550 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD04004550?
Check Price and Availability of MFCD04004550, 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 MFCD04004550 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD04004550
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD04004550
  • 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 MFCD04004550 available by request