V004-4925 Screening compound: N-{4-[3-[(4-fluorobenzyl)oxy]-5-(2-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide

V004-4925 Screening compound: N-{4-[3-[(4-fluorobenzyl)oxy]-5-(2-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
V004-4925 Screening compound: N-{4-[3-[(4-fluorobenzyl)oxy]-5-(2-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-4925
N-{4-[3-[(4-fluorobenzyl)oxy]-5-(2-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide

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

V004-4925

Molecular Formula

C26H24F2N4O2 (C26 H24 F2 N4 O2)

Compound Name

N-{4-[3-[(4-fluorobenzyl)oxy]-5-(2-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide

IUPAC name

N-{4-[5-(2-fluorophenyl)-3-[(4-fluorophenyl)methoxy]-1H-124-triazol-1-yl]phenyl}-3-methylbutanamide

SMILES

CC(C)CC(Nc(cc1)ccc1-n(c(-c(cccc1)c1F)n1)nc1OCc(cc1)ccc1F)=O

InChI

InChI=1S/C26H24F2N4O2/c1-17(2)15-24(33)29-20-11-13-21(14-12-20)32-25(22-5-3-4-6-23(22)28)30-26(31-32)34-16-18-7-9-19(27)10-8-18/h3-14,17H,15-16H2,1-2H3,(H,29,33)

InChI Key

GBANDPJKOXGOIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19783860

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

462.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.910

Distribution Coefficient, logD

5.910

Water Solubility, LogSw

-5.62

Polar Surface Area

54.067

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.23

References: we are preparing a list of scientific research reports with V004-4925 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-4925?
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What is the minimum amount of V004-4925 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-4925
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-4925
  • 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 V004-4925 available by request