V016-3329 Screening compound: 2-(4-fluorophenyl)-4-[(3-methylphenyl)methyl]-6-(4-methylpiperazine-1-carbonyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

V016-3329 Screening compound: 2-(4-fluorophenyl)-4-[(3-methylphenyl)methyl]-6-(4-methylpiperazine-1-carbonyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione
V016-3329 Screening compound: 2-(4-fluorophenyl)-4-[(3-methylphenyl)methyl]-6-(4-methylpiperazine-1-carbonyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-3329
2-(4-fluorophenyl)-4-[(3-methylphenyl)methyl]-6-(4-methylpiperazine-1-carbonyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

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

V016-3329

Molecular Formula

C23H24FN5O3 (C23 H24 FN5 O3)

Compound Name

2-(4-fluorophenyl)-4-[(3-methylphenyl)methyl]-6-(4-methylpiperazine-1-carbonyl)-2,3,4,5-tetrahydro-1,2,4-triazine-3,5-dione

IUPAC name

2-(4-fluorophenyl)-4-[(3-methylphenyl)methyl]-6-(4-methylpiperazine-1-carbonyl)-2345-tetrahydro-124-triazine-35-dione

SMILES

Cc1cccc(CN(C(C(C(N2CCN(C)CC2)=O)=NN2c(cc3)ccc3F)=O)C2=O)c1

InChI

InChI=1S/C23H24FN5O3/c1-16-4-3-5-17(14-16)15-28-22(31)20(21(30)27-12-10-26(2)11-13-27)25-29(23(28)32)19-8-6-18(24)7-9-19/h3-9,14H,10-13,15H2,1-2H3

InChI Key

GDJFBCKVVJMLCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19838040

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

437.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.731

Distribution Coefficient, logD

2.686

Water Solubility, LogSw

-2.90

Polar Surface Area

62.370

Acid Dissociation Constant (pKa)

28.73

Base Dissociation Constant (pKb)

6.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V016-3329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-3329?
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What is the minimum amount of V016-3329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-3329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-3329
  • 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 V016-3329 available by request