1490-0064 Screening compound: N-(2,2,2-trichloro-1-{[2-chloro-5-(trifluoromethyl)phenyl]amino}ethyl)pyridine-3-carboxamide

1490-0064 Screening compound: N-(2,2,2-trichloro-1-{[2-chloro-5-(trifluoromethyl)phenyl]amino}ethyl)pyridine-3-carboxamide
1490-0064 Screening compound: N-(2,2,2-trichloro-1-{[2-chloro-5-(trifluoromethyl)phenyl]amino}ethyl)pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1490-0064
N-(2,2,2-trichloro-1-{[2-chloro-5-(trifluoromethyl)phenyl]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

1490-0064

Molecular Formula

C15H10Cl4F3N3O (C15 H10 Cl4 F3 N3 O)

Compound Name

N-(2,2,2-trichloro-1-{[2-chloro-5-(trifluoromethyl)phenyl]amino}ethyl)pyridine-3-carboxamide

IUPAC name

N-(222-trichloro-1-{[2-chloro-5-(trifluoromethyl)phenyl]amino}ethyl)pyridine-3-carboxamide

SMILES

O=C(c1cnccc1)NC(C(Cl)(Cl)Cl)Nc(cc(C(F)(F)F)cc1)c1Cl

InChI

InChI=1S/C15H10Cl4F3N3O/c16-10-4-3-9(15(20,21)22)6-11(10)24-13(14(17,18)19)25-12(26)8-2-1-5-23-7-8/h1-7,13,24H,(H,25,26)/t13-/m1/s1

InChI Key

YZENESUZOSIEII-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD00372115

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.07

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.230

Distribution Coefficient, logD

3.815

Water Solubility, LogSw

-4.61

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

References: we are preparing a list of scientific research reports with 1490-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1490-0064?
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What is the minimum amount of 1490-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1490-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1490-0064
  • 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 1490-0064 available by request