D335-3189 Screening compound: N-{2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}-2-(2-nitrophenoxy)acetamide

D335-3189 Screening compound: N-{2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}-2-(2-nitrophenoxy)acetamide
D335-3189 Screening compound: N-{2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}-2-(2-nitrophenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D335-3189
N-{2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}-2-(2-nitrophenoxy)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

D335-3189

Molecular Formula

C20H19N3O5S (C20 H19 N3 O5 S)

Compound Name

N-{2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethyl}-2-(2-nitrophenoxy)acetamide

IUPAC name

N-{2-[2-(4-methoxyphenyl)-13-thiazol-4-yl]ethyl}-2-(2-nitrophenoxy)acetamide

SMILES

COc(cc1)ccc1-c1nc(CCNC(COc(cccc2)c2[N+]([O-])=O)=O)cs1

InChI

InChI=1S/C20H19N3O5S/c1-27-16-8-6-14(7-9-16)20-22-15(13-29-20)10-11-21-19(24)12-28-18-5-3-2-4-17(18)23(25)26/h2-9,13H,10-12H2,1H3,(H,21,24)

InChI Key

MNOQWNLHVCJHEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12920545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.360

Distribution Coefficient, logD

3.360

Water Solubility, LogSw

-3.77

Polar Surface Area

82.719

Acid Dissociation Constant (pKa)

14.86

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D335-3189 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D335-3189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D335-3189?
Check Price and Availability of D335-3189, 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 D335-3189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D335-3189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D335-3189
  • 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 D335-3189 available by request