V025-1543 Screening compound: N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide

V025-1543 Screening compound: N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide
V025-1543 Screening compound: N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-1543
N-(4-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-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

V025-1543

Molecular Formula

C24H18F3N5O4 (C24 H18 F3 N5 O4)

Compound Name

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

IUPAC name

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

SMILES

CCOc(nc1-c2ccc(C(F)(F)F)cc2)nn1-c(cc1)ccc1NC(c(cc1)ccc1[N+]([O-])=O)=O

InChI

InChI=1S/C24H18F3N5O4/c1-2-36-23-29-21(15-3-7-17(8-4-15)24(25,26)27)31(30-23)19-13-9-18(10-14-19)28-22(33)16-5-11-20(12-6-16)32(34)35/h3-14H,2H2,1H3,(H,28,33)

InChI Key

DWBIPIFDPKJCDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19763004

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

497.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.954

Distribution Coefficient, logD

5.954

Water Solubility, LogSw

-5.61

Polar Surface Area

87.286

Acid Dissociation Constant (pKa)

10.91

Base Dissociation Constant (pKb)

1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with V025-1543 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-1543?
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What is the minimum amount of V025-1543 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-1543
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-1543
  • 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 V025-1543 available by request