V028-9469 Screening compound: 6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-(4-methanesulfonylphenyl)-2,5-dihydro-1,2,4-triazin-5-one

V028-9469 Screening compound: 6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-(4-methanesulfonylphenyl)-2,5-dihydro-1,2,4-triazin-5-one
V028-9469 Screening compound: 6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-(4-methanesulfonylphenyl)-2,5-dihydro-1,2,4-triazin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-9469
6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-(4-methanesulfonylphenyl)-2,5-dihydro-1,2,4-triazin-5-one

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

V028-9469

Molecular Formula

C23H24FN5O4S (C23 H24 FN5 O4 S)

Compound Name

6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-(4-methanesulfonylphenyl)-2,5-dihydro-1,2,4-triazin-5-one

IUPAC name

6-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-(4-methanesulfonylphenyl)-25-dihydro-124-triazin-5-one

SMILES

CS(c(cc1)ccc1C(NN=C1CCC(N(CC2)CCN2c(cccc2)c2F)=O)=NC1=O)(=O)=O

InChI

InChI=1S/C23H24FN5O4S/c1-34(32,33)17-8-6-16(7-9-17)22-25-23(31)19(26-27-22)10-11-21(30)29-14-12-28(13-15-29)20-5-3-2-4-18(20)24/h2-9H,10-15H2,1H3,(H,25,27,31)

InChI Key

FUPNVXUGIHWRLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14264873

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.140

Distribution Coefficient, logD

1.140

Water Solubility, LogSw

-2.34

Polar Surface Area

95.409

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

V028-9469 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V028-9469 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-9469?
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What is the minimum amount of V028-9469 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-9469
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-9469
  • 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 V028-9469 available by request