D333-0317 Screening compound: N-(2-ethoxyphenyl)-2-{2-[(3-methylphenoxy)methyl]-1,3-thiazol-4-yl}acetamide

D333-0317 Screening compound: N-(2-ethoxyphenyl)-2-{2-[(3-methylphenoxy)methyl]-1,3-thiazol-4-yl}acetamide
D333-0317 Screening compound: N-(2-ethoxyphenyl)-2-{2-[(3-methylphenoxy)methyl]-1,3-thiazol-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D333-0317
N-(2-ethoxyphenyl)-2-{2-[(3-methylphenoxy)methyl]-1,3-thiazol-4-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

D333-0317

Molecular Formula

C21H22N2O3S (C21 H22 N2 O3 S)

Compound Name

N-(2-ethoxyphenyl)-2-{2-[(3-methylphenoxy)methyl]-1,3-thiazol-4-yl}acetamide

IUPAC name

N-(2-ethoxyphenyl)-2-{2-[(3-methylphenoxy)methyl]-13-thiazol-4-yl}acetamide

SMILES

CCOc(cccc1)c1NC(Cc1csc(COc2cc(C)ccc2)n1)=O

InChI

InChI=1S/C21H22N2O3S/c1-3-25-19-10-5-4-9-18(19)23-20(24)12-16-14-27-21(22-16)13-26-17-8-6-7-15(2)11-17/h4-11,14H,3,12-13H2,1-2H3,(H,23,24)

InChI Key

NKENYBFWEHOGRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09540835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.619

Distribution Coefficient, logD

4.619

Water Solubility, LogSw

-4.38

Polar Surface Area

47.852

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

D333-0317 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Receptors Annotated Library (5376 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D333-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D333-0317?
Check Price and Availability of D333-0317, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D333-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D333-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D333-0317
  • 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 D333-0317 available by request