V001-0169 Screening compound: N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzamide

V001-0169 Screening compound: N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzamide
V001-0169 Screening compound: N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-0169
N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-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

V001-0169

Molecular Formula

C24H18F4N4O2 (C24 H18 F4 N4 O2)

Compound Name

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

IUPAC name

N-(4-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-124-triazol-1-yl}phenyl)-4-fluorobenzamide

SMILES

CCOc(nc1-c2cc(C(F)(F)F)ccc2)nn1-c(cc1)ccc1NC(c(cc1)ccc1F)=O

InChI

InChI=1S/C24H18F4N4O2/c1-2-34-23-30-21(16-4-3-5-17(14-16)24(26,27)28)32(31-23)20-12-10-19(11-13-20)29-22(33)15-6-8-18(25)9-7-15/h3-14H,2H2,1H3,(H,29,33)

InChI Key

GXDIEAYMRSXKHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14411833

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

470.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.987

Distribution Coefficient, logD

5.986

Water Solubility, LogSw

-5.64

Polar Surface Area

53.905

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with V001-0169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-0169?
Check Price and Availability of V001-0169, 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 V001-0169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-0169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-0169
  • 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 V001-0169 available by request