V029-4306 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-2-fluorobenzamide

V029-4306 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-2-fluorobenzamide
V029-4306 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-2-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4306
N-{4-[3-(2-ethoxyethoxy)-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-2-fluorobenzamide

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

V029-4306

Molecular Formula

C23H21FN4O4 (C23 H21 FN4 O4)

Compound Name

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

IUPAC name

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

SMILES

CCOCCOc(nc1-c2ccco2)nn1-c(cc1)ccc1NC(c(cccc1)c1F)=O

InChI

InChI=1S/C23H21FN4O4/c1-2-30-14-15-32-23-26-21(20-8-5-13-31-20)28(27-23)17-11-9-16(10-12-17)25-22(29)18-6-3-4-7-19(18)24/h3-13H,2,14-15H2,1H3,(H,25,29)

InChI Key

HOFMJPXDUYXKBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19783913

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

436.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.788

Distribution Coefficient, logD

3.787

Water Solubility, LogSw

-4.00

Polar Surface Area

70.755

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

V029-4306 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 V029-4306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4306?
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What is the minimum amount of V029-4306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4306
  • 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 V029-4306 available by request