Screening compound: ALFVPOBMPUTKNB-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
ALFVPOBMPUTKNB-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

Y043-6051

Molecular Formula

C21H24ClN5O2S (C21 H24 ClN5 O2 S)

Compound Name

1-[4-(4-chlorophenyl)-4-hydroxypiperidino]-2-[(3-isopropyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-1-ethanone

IUPAC name

1-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-{[3-(propan-2-yl)-[124]triazolo[43-b]pyridazin-6-yl]sulfanyl}ethan-1-one

SMILES

CC(C)c1nnc(cc2)n1nc2SCC(N(CC1)CCC1(c(cc1)ccc1Cl)O)=O

InChI

InChI=1S/C21H24ClN5O2S/c1-14(2)20-24-23-17-7-8-18(25-27(17)20)30-13-19(28)26-11-9-21(29,10-12-26)15-3-5-16(22)6-4-15/h3-8,14,29H,9-13H2,1-2H3

InChI Key

ALFVPOBMPUTKNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30836017

ALFVPOBMPUTKNB-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 ALFVPOBMPUTKNB-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

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