V008-7539 Screening compound: N-(4-{3-[(4-fluorophenyl)methoxy]-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)-3-nitrobenzamide

V008-7539 Screening compound: N-(4-{3-[(4-fluorophenyl)methoxy]-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)-3-nitrobenzamide
V008-7539 Screening compound: N-(4-{3-[(4-fluorophenyl)methoxy]-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-7539
N-(4-{3-[(4-fluorophenyl)methoxy]-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)-3-nitrobenzamide

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

V008-7539

Molecular Formula

C26H18FN5O5 (C26 H18 FN5 O5)

Compound Name

N-(4-{3-[(4-fluorophenyl)methoxy]-5-(furan-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)-3-nitrobenzamide

IUPAC name

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

SMILES

[O-][N+](c1cccc(C(Nc(cc2)ccc2-n(c(-c2ccco2)n2)nc2OCc(cc2)ccc2F)=O)c1)=O

InChI

InChI=1S/C26H18FN5O5/c27-19-8-6-17(7-9-19)16-37-26-29-24(23-5-2-14-36-23)31(30-26)21-12-10-20(11-13-21)28-25(33)18-3-1-4-22(15-18)32(34)35/h1-15H,16H2,(H,28,33)

InChI Key

MXOWNSZKPXSRRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19789511

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.235

Distribution Coefficient, logD

5.234

Water Solubility, LogSw

-5.47

Polar Surface Area

95.969

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

0.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.80

References: we are preparing a list of scientific research reports with V008-7539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-7539?
Check Price and Availability of V008-7539, 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 V008-7539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-7539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-7539
  • 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 V008-7539 available by request