V010-5221 Screening compound: N-[3-(2H-1,3-benzodioxol-5-yl)-5-propyl-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide

V010-5221 Screening compound: N-[3-(2H-1,3-benzodioxol-5-yl)-5-propyl-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide
V010-5221 Screening compound: N-[3-(2H-1,3-benzodioxol-5-yl)-5-propyl-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-5221
N-[3-(2H-1,3-benzodioxol-5-yl)-5-propyl-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide

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

V010-5221

Molecular Formula

C21H18F3N3O3 (C21 H18 F3 N3 O3)

Compound Name

N-[3-(2H-1,3-benzodioxol-5-yl)-5-propyl-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide

IUPAC name

N-[3-(2H-13-benzodioxol-5-yl)-5-propyl-1H-pyrazol-4-yl]-4-(trifluoromethyl)benzamide

SMILES

CCCc([nH]nc1-c(cc2)cc3c2OCO3)c1NC(c1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C21H18F3N3O3/c1-2-3-15-19(25-20(28)12-4-7-14(8-5-12)21(22,23)24)18(27-26-15)13-6-9-16-17(10-13)30-11-29-16/h4-10H,2-3,11H2,1H3,(H,25,28)(H,26,27)

InChI Key

FWTSXBFFNJURRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14266445

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

417.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.494

Distribution Coefficient, logD

4.493

Water Solubility, LogSw

-4.34

Polar Surface Area

63.575

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

-1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V010-5221 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V010-5221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-5221?
Check Price and Availability of V010-5221, 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 V010-5221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-5221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-5221
  • 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 V010-5221 available by request