1309-1123 Screening compound: N-{2,2,2-trichloro-1-[(2-methylphenyl)amino]ethyl}pyridine-3-carboxamide

1309-1123 Screening compound: N-{2,2,2-trichloro-1-[(2-methylphenyl)amino]ethyl}pyridine-3-carboxamide
1309-1123 Screening compound: N-{2,2,2-trichloro-1-[(2-methylphenyl)amino]ethyl}pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1309-1123
N-{2,2,2-trichloro-1-[(2-methylphenyl)amino]ethyl}pyridine-3-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

1309-1123

Molecular Formula

C15H14Cl3N3O (C15 H14 Cl3 N3 O)

Compound Name

N-{2,2,2-trichloro-1-[(2-methylphenyl)amino]ethyl}pyridine-3-carboxamide

IUPAC name

N-{222-trichloro-1-[(2-methylphenyl)amino]ethyl}pyridine-3-carboxamide

SMILES

Cc(cccc1)c1NC(C(Cl)(Cl)Cl)NC(c1cnccc1)=O

InChI

InChI=1S/C15H14Cl3N3O/c1-10-5-2-3-7-12(10)20-14(15(16,17)18)21-13(22)11-6-4-8-19-9-11/h2-9,14,20H,1H3,(H,21,22)/t14-/m1/s1

InChI Key

YNIRFGLOBODYIT-CQSZACIVSA-N

MDL Number (MFCD)

MFCD00402055

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.65

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.940

Distribution Coefficient, logD

2.526

Water Solubility, LogSw

-3.47

Polar Surface Area

42.270

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

1309-1123 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1309-1123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1309-1123?
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What is the minimum amount of 1309-1123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1309-1123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1309-1123
  • 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 1309-1123 available by request