V025-1142 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-nitrobenzamide

V025-1142 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-nitrobenzamide
V025-1142 Screening compound: N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-1142
N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-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

V025-1142

Molecular Formula

C25H22FN5O5 (C25 H22 FN5 O5)

Compound Name

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

IUPAC name

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

SMILES

CCOCCOc(nc1-c2cccc(F)c2)nn1-c(cc1)ccc1NC(c1cc([N+]([O-])=O)ccc1)=O

InChI

InChI=1S/C25H22FN5O5/c1-2-35-13-14-36-25-28-23(17-5-3-7-19(26)15-17)30(29-25)21-11-9-20(10-12-21)27-24(32)18-6-4-8-22(16-18)31(33)34/h3-12,15-16H,2,13-14H2,1H3,(H,27,32)

InChI Key

PCDRRFNTBSNXGI-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.922

Distribution Coefficient, logD

4.921

Water Solubility, LogSw

-4.67

Polar Surface Area

95.558

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with V025-1142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-1142?
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What is the minimum amount of V025-1142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-1142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-1142
  • 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 V025-1142 available by request