F414-1098 Screening compound: N-(2,5-diethoxyphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide

F414-1098 Screening compound: N-(2,5-diethoxyphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide
F414-1098 Screening compound: N-(2,5-diethoxyphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F414-1098
N-(2,5-diethoxyphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide

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

F414-1098

Molecular Formula

C20H23N5O4 (C20 H23 N5 O4)

Compound Name

N-(2,5-diethoxyphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide

IUPAC name

N-(25-diethoxyphenyl)-5-[(4-methoxyphenyl)amino]-1H-123-triazole-4-carboxamide

SMILES

CCOc(cc1)cc(NC(c2c(Nc(cc3)ccc3OC)[nH]nn2)=O)c1OCC

InChI

InChI=1S/C20H23N5O4/c1-4-28-15-10-11-17(29-5-2)16(12-15)22-20(26)18-19(24-25-23-18)21-13-6-8-14(27-3)9-7-13/h6-12H,4-5H2,1-3H3,(H,22,26)(H2,21,23,24,25)

InChI Key

HYYQNJVTHUTGLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16637818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.377

Distribution Coefficient, logD

3.311

Water Solubility, LogSw

-3.60

Polar Surface Area

90.735

Acid Dissociation Constant (pKa)

8.19

Base Dissociation Constant (pKb)

-2.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F414-1098 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F414-1098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F414-1098?
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What is the minimum amount of F414-1098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F414-1098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F414-1098
  • 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 F414-1098 available by request