E919-1189 Screening compound: 5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(4-methylbenzyl)-1H-1,2,3-triazole-4-carboxamide

E919-1189 Screening compound: 5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(4-methylbenzyl)-1H-1,2,3-triazole-4-carboxamide
E919-1189 Screening compound: 5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(4-methylbenzyl)-1H-1,2,3-triazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E919-1189
5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(4-methylbenzyl)-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

E919-1189

Molecular Formula

C21H24N6O2 (C21 H24 N6 O2)

Compound Name

5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(4-methylbenzyl)-1H-1,2,3-triazole-4-carboxamide

IUPAC name

n/a

SMILES

Cc1ccc(CNC(c2c(N)n(CC(Nc3c(C)c(C)ccc3)=O)nn2)=O)cc1

InChI

InChI=1S/C21H24N6O2/c1-13-7-9-16(10-8-13)11-23-21(29)19-20(22)27(26-25-19)12-18(28)24-17-6-4-5-14(2)15(17)3/h4-10H,11-12,22H2,1-3H3,(H,23,29)(H,24,28)

InChI Key

UHOUJQIOYHAACJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14927970

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.334

Distribution Coefficient, logD

2.334

Water Solubility, LogSw

-2.70

Polar Surface Area

93.061

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

1.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.81

E919-1189 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E919-1189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E919-1189?
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What is the minimum amount of E919-1189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E919-1189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E919-1189
  • 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 E919-1189 available by request