V020-8959 Screening compound: 6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-2,5-dihydro-1,2,4-triazin-5-one

V020-8959 Screening compound: 6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-2,5-dihydro-1,2,4-triazin-5-one
V020-8959 Screening compound: 6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-2,5-dihydro-1,2,4-triazin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-8959
6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-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

V020-8959

Molecular Formula

C26H28FN5O4 (C26 H28 FN5 O4)

Compound Name

6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-2,5-dihydro-1,2,4-triazin-5-one

IUPAC name

6-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-3-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-25-dihydro-124-triazin-5-one

SMILES

COc(cc(cc1)C(NN=C2CCC(N(CC3)CCN3c(cc3)ccc3F)=O)=NC2=O)c1OCC=C

InChI

InChI=1S/C26H28FN5O4/c1-3-16-36-22-10-4-18(17-23(22)35-2)25-28-26(34)21(29-30-25)9-11-24(33)32-14-12-31(13-15-32)20-7-5-19(27)6-8-20/h3-8,10,17H,1,9,11-16H2,2H3,(H,28,30,34)

InChI Key

GVHGJUPTLWGYAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14264138

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

493.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.626

Distribution Coefficient, logD

2.626

Water Solubility, LogSw

-3.11

Polar Surface Area

81.096

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

3.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

V020-8959 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 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
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V020-8959 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-8959?
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What is the minimum amount of V020-8959 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-8959
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-8959
  • 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 V020-8959 available by request