V024-0986 Screening compound: (butan-2-yl)({[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl})[(3-methylthiophen-2-yl)methyl]amine

V024-0986 Screening compound: (butan-2-yl)({[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl})[(3-methylthiophen-2-yl)methyl]amine
V024-0986 Screening compound: (butan-2-yl)({[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl})[(3-methylthiophen-2-yl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-0986
(butan-2-yl)({[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl})[(3-methylthiophen-2-yl)methyl]amine

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

V024-0986

Molecular Formula

C27H38FN5S (C27 H38 FN5 S)

Compound Name

(butan-2-yl)({[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl})[(3-methylthiophen-2-yl)methyl]amine

IUPAC name

(butan-2-yl)({[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl})[(3-methylthiophen-2-yl)methyl]amine

SMILES

CCC(C)N(Cc(c(C)nn1-c(cc2)ccc2F)c1N1CCN(CC)CC1)Cc1c(C)ccs1

InChI

InChI=1S/C27H38FN5S/c1-6-21(4)32(19-26-20(3)12-17-34-26)18-25-22(5)29-33(24-10-8-23(28)9-11-24)27(25)31-15-13-30(7-2)14-16-31/h8-12,17,21H,6-7,13-16,18-19H2,1-5H3/t21-/m0/s1

InChI Key

OLLLVGRAJXQJPS-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14284889

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

483.7

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.667

Distribution Coefficient, logD

1.104

Water Solubility, LogSw

-5.53

Polar Surface Area

24.402

Acid Dissociation Constant (pKa)

23.97

Base Dissociation Constant (pKb)

11.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

51.90

V024-0986 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V024-0986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-0986?
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What is the minimum amount of V024-0986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-0986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-0986
  • 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 V024-0986 available by request