D508-0053 Screening compound: 2-(4-chloro-3-methylphenoxy)-N-[(3-fluorophenyl)methyl]-N-(pyridin-2-yl)acetamide

D508-0053 Screening compound: 2-(4-chloro-3-methylphenoxy)-N-[(3-fluorophenyl)methyl]-N-(pyridin-2-yl)acetamide
D508-0053 Screening compound: 2-(4-chloro-3-methylphenoxy)-N-[(3-fluorophenyl)methyl]-N-(pyridin-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D508-0053
2-(4-chloro-3-methylphenoxy)-N-[(3-fluorophenyl)methyl]-N-(pyridin-2-yl)acetamide

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

D508-0053

Molecular Formula

C21H18ClFN2O2 (C21 H18 ClFN2 O2)

Compound Name

2-(4-chloro-3-methylphenoxy)-N-[(3-fluorophenyl)methyl]-N-(pyridin-2-yl)acetamide

IUPAC name

2-(4-chloro-3-methylphenoxy)-N-[(3-fluorophenyl)methyl]-N-(pyridin-2-yl)acetamide

SMILES

Cc(cc(cc1)OCC(N(Cc2cc(F)ccc2)c2ncccc2)=O)c1Cl

InChI

InChI=1S/C21H18ClFN2O2/c1-15-11-18(8-9-19(15)22)27-14-21(26)25(20-7-2-3-10-24-20)13-16-5-4-6-17(23)12-16/h2-12H,13-14H2,1H3

InChI Key

LCLKJNJOCXTWQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18076956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.372

Distribution Coefficient, logD

5.372

Water Solubility, LogSw

-5.90

Polar Surface Area

31.073

Acid Dissociation Constant (pKa)

23.09

Base Dissociation Constant (pKb)

1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with D508-0053 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D508-0053?
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What is the minimum amount of D508-0053 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D508-0053
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D508-0053
  • 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 D508-0053 available by request