V018-6479 Screening compound: {[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}[(3-methoxyphenyl)methyl](2-methylpropyl)amine

V018-6479 Screening compound: {[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}[(3-methoxyphenyl)methyl](2-methylpropyl)amine
V018-6479 Screening compound: {[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}[(3-methoxyphenyl)methyl](2-methylpropyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-6479
{[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}[(3-methoxyphenyl)methyl](2-methylpropyl)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

V018-6479

Molecular Formula

C29H40FN5O (C29 H40 FN5 O)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC1)CCN1c1c(CN(CC(C)C)Cc2cc(OC)ccc2)c(C)nn1-c(cc1)ccc1F

InChI

InChI=1S/C29H40FN5O/c1-6-32-14-16-34(17-15-32)29-28(23(4)31-35(29)26-12-10-25(30)11-13-26)21-33(19-22(2)3)20-24-8-7-9-27(18-24)36-5/h7-13,18,22H,6,14-17,19-21H2,1-5H3

InChI Key

GKWIKLAZWSZADV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14284876

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

493.67

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.468

Distribution Coefficient, logD

-0.606

Water Solubility, LogSw

-5.58

Polar Surface Area

31.707

Acid Dissociation Constant (pKa)

24.17

Base Dissociation Constant (pKb)

13.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.30

V018-6479 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 V018-6479 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-6479?
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What is the minimum amount of V018-6479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-6479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-6479
  • 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 V018-6479 available by request