Screening compound: KUBABJCCCJMZSW-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
KUBABJCCCJMZSW-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

V008-2317

Molecular Formula

C27H30FN5O3S (C27 H30 FN5 O3 S)

Compound Name

1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(1-{3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl}piperidine-4-carbonyl)piperazine

IUPAC name

1-[(2H-13-benzodioxol-5-yl)methyl]-4-(1-{3-[(4-fluorophenyl)methyl]-124-thiadiazol-5-yl}piperidine-4-carbonyl)piperazine

SMILES

O=C(C(CC1)CCN1c1nc(Cc(cc2)ccc2F)ns1)N1CCN(Cc(cc2)cc3c2OCO3)CC1

InChI

InChI=1S/C27H30FN5O3S/c28-22-4-1-19(2-5-22)16-25-29-27(37-30-25)33-9-7-21(8-10-33)26(34)32-13-11-31(12-14-32)17-20-3-6-23-24(15-20)36-18-35-23/h1-6,15,21H,7-14,16-18H2

InChI Key

KUBABJCCCJMZSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19745468

KUBABJCCCJMZSW-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

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

Frequently Asked Questions

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