D335-2899 Screening compound: 2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide

D335-2899 Screening compound: 2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide
D335-2899 Screening compound: 2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D335-2899
2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]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

D335-2899

Molecular Formula

C16H19ClN2O2S (C16 H19 ClN2 O2 S)

Compound Name

2-(4-chloro-3,5-dimethylphenoxy)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide

IUPAC name

2-(4-chloro-35-dimethylphenoxy)-N-[2-(2-methyl-13-thiazol-4-yl)ethyl]acetamide

SMILES

Cc1nc(CCNC(COc(cc2C)cc(C)c2Cl)=O)cs1

InChI

InChI=1S/C16H19ClN2O2S/c1-10-6-14(7-11(2)16(10)17)21-8-15(20)18-5-4-13-9-22-12(3)19-13/h6-7,9H,4-5,8H2,1-3H3,(H,18,20)

InChI Key

UNDGMSZCMXFIKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12918344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.624

Distribution Coefficient, logD

3.624

Water Solubility, LogSw

-4.30

Polar Surface Area

42.086

Acid Dissociation Constant (pKa)

14.86

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

D335-2899 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with D335-2899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D335-2899?
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What is the minimum amount of D335-2899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D335-2899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D335-2899
  • 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 D335-2899 available by request