V028-4167 Screening compound: N-(cyclopropylmethyl)-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}cyclobutanecarboxamide

V028-4167 Screening compound: N-(cyclopropylmethyl)-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}cyclobutanecarboxamide
V028-4167 Screening compound: N-(cyclopropylmethyl)-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-4167
N-(cyclopropylmethyl)-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}cyclobutanecarboxamide

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

V028-4167

Molecular Formula

C22H27F3N4O (C22 H27 F3 N4 O)

Compound Name

N-(cyclopropylmethyl)-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}cyclobutanecarboxamide

IUPAC name

N-(cyclopropylmethyl)-N-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}cyclobutanecarboxamide

SMILES

CN(C)c1c(CN(CC2CC2)C(C2CCC2)=O)c(C(F)(F)F)nn1-c1ccccc1

InChI

InChI=1S/C22H27F3N4O/c1-27(2)20-18(14-28(13-15-11-12-15)21(30)16-7-6-8-16)19(22(23,24)25)26-29(20)17-9-4-3-5-10-17/h3-5,9-10,15-16H,6-8,11-14H2,1-2H3

InChI Key

HNNNAGLMAYJVAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19805602

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.48

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

4.029

Distribution Coefficient, logD

4.029

Water Solubility, LogSw

-4.12

Polar Surface Area

33.446

Acid Dissociation Constant (pKa)

23.04

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

V028-4167 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V028-4167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-4167?
Check Price and Availability of V028-4167, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V028-4167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-4167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-4167
  • 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 V028-4167 available by request