V028-5931 Screening compound: 1-[3-(2,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazino)-1-ethanone

V028-5931 Screening compound: 1-[3-(2,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazino)-1-ethanone
V028-5931 Screening compound: 1-[3-(2,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazino)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-5931
1-[3-(2,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazino)-1-ethanone

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

V028-5931

Molecular Formula

C25H31FN4O (C25 H31 FN4 O)

Compound Name

1-[3-(2,4-dimethylphenyl)-5-(3-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazino)-1-ethanone

IUPAC name

1-[3-(24-dimethylphenyl)-5-(3-fluorophenyl)-45-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one

SMILES

CCN1CCN(CC(N(C(C2)c3cccc(F)c3)N=C2c2c(C)cc(C)cc2)=O)CC1

InChI

InChI=1S/C25H31FN4O/c1-4-28-10-12-29(13-11-28)17-25(31)30-24(20-6-5-7-21(26)15-20)16-23(27-30)22-9-8-18(2)14-19(22)3/h5-9,14-15,24H,4,10-13,16-17H2,1-3H3/t24-/m0/s1

InChI Key

KBVXIVJDLIDABM-DEOSSOPVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

422.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.130

Distribution Coefficient, logD

3.336

Water Solubility, LogSw

-4.08

Polar Surface Area

34.128

Acid Dissociation Constant (pKa)

18.73

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with V028-5931 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-5931?
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What is the minimum amount of V028-5931 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-5931
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-5931
  • 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 V028-5931 available by request