C323-0024 Screening compound: 5-[(4-ethoxyphenyl)amino]-4-nitro-2-phenyl-2H-1,2,3-triazol-1-ium-1-olate

C323-0024 Screening compound: 5-[(4-ethoxyphenyl)amino]-4-nitro-2-phenyl-2H-1,2,3-triazol-1-ium-1-olate
C323-0024 Screening compound: 5-[(4-ethoxyphenyl)amino]-4-nitro-2-phenyl-2H-1,2,3-triazol-1-ium-1-olate alternative view

Chemical Structure Depiction of ChemDiv screening compound C323-0024
5-[(4-ethoxyphenyl)amino]-4-nitro-2-phenyl-2H-1,2,3-triazol-1-ium-1-olate

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

C323-0024

Molecular Formula

C16H15N5O4 (C16 H15 N5 O4)

Compound Name

5-[(4-ethoxyphenyl)amino]-4-nitro-2-phenyl-2H-1,2,3-triazol-1-ium-1-olate

IUPAC name

5-[(4-ethoxyphenyl)amino]-4-nitro-2-phenyl-2H-123-triazol-1-ium-1-olate

SMILES

CCOc(cc1)ccc1Nc(c([N+]([O-])=O)nn1-c2ccccc2)[n+]1[O-]

InChI

InChI=1S/C16H15N5O4/c1-2-25-14-10-8-12(9-11-14)17-15-16(21(23)24)18-19(20(15)22)13-6-4-3-5-7-13/h3-11,17H,2H2,1H3

InChI Key

LCMAUQJJLHRQGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06006465

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.244

Distribution Coefficient, logD

3.244

Water Solubility, LogSw

-3.43

Polar Surface Area

83.207

Acid Dissociation Constant (pKa)

14.62

Base Dissociation Constant (pKb)

-2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with C323-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C323-0024?
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What is the minimum amount of C323-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C323-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C323-0024
  • 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 C323-0024 available by request