V006-8962 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl]phenyl}-2-methoxyacetamide

V006-8962 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl]phenyl}-2-methoxyacetamide
V006-8962 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl]phenyl}-2-methoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-8962
N-{4-[3-(2-ethoxyethoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl]phenyl}-2-methoxyacetamide

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

V006-8962

Molecular Formula

C22H23F3N4O4 (C22 H23 F3 N4 O4)

Compound Name

N-{4-[3-(2-ethoxyethoxy)-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl]phenyl}-2-methoxyacetamide

IUPAC name

N-{4-[3-(2-ethoxyethoxy)-5-[4-(trifluoromethyl)phenyl]-1H-124-triazol-1-yl]phenyl}-2-methoxyacetamide

SMILES

CCOCCOc(nc1-c2ccc(C(F)(F)F)cc2)nn1-c(cc1)ccc1NC(COC)=O

InChI

InChI=1S/C22H23F3N4O4/c1-3-32-12-13-33-21-27-20(15-4-6-16(7-5-15)22(23,24)25)29(28-21)18-10-8-17(9-11-18)26-19(30)14-31-2/h4-11H,3,12-14H2,1-2H3,(H,26,30)

InChI Key

LSKVNCARWJVJJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19749895

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

464.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.058

Distribution Coefficient, logD

4.058

Water Solubility, LogSw

-4.22

Polar Surface Area

70.658

Acid Dissociation Constant (pKa)

12.64

Base Dissociation Constant (pKb)

0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

V006-8962 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V006-8962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-8962?
Check Price and Availability of V006-8962, 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 V006-8962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-8962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-8962
  • 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 V006-8962 available by request