1490-0065 Screening compound: N-{2,2,2-trichloro-1-[(2,4-dimethylphenyl)amino]ethyl}pyridine-3-carboxamide

1490-0065 Screening compound: N-{2,2,2-trichloro-1-[(2,4-dimethylphenyl)amino]ethyl}pyridine-3-carboxamide
1490-0065 Screening compound: N-{2,2,2-trichloro-1-[(2,4-dimethylphenyl)amino]ethyl}pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1490-0065
N-{2,2,2-trichloro-1-[(2,4-dimethylphenyl)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

1490-0065

Molecular Formula

C16H16Cl3N3O (C16 H16 Cl3 N3 O)

Compound Name

N-{2,2,2-trichloro-1-[(2,4-dimethylphenyl)amino]ethyl}pyridine-3-carboxamide

IUPAC name

N-{222-trichloro-1-[(24-dimethylphenyl)amino]ethyl}pyridine-3-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(C(Cl)(Cl)Cl)NC(c1cnccc1)=O

InChI

InChI=1S/C16H16Cl3N3O/c1-10-5-6-13(11(2)8-10)21-15(16(17,18)19)22-14(23)12-4-3-7-20-9-12/h3-9,15,21H,1-2H3,(H,22,23)/t15-/m1/s1

InChI Key

WFTLSOZHUALAAC-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD00392140

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.68

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

3.628

Distribution Coefficient, logD

3.213

Water Solubility, LogSw

-3.87

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

25.00

1490-0065 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1490-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1490-0065?
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What is the minimum amount of 1490-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1490-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1490-0065
  • 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 1490-0065 available by request