2389-2694 Screening compound: (2E)-N-(5-benzyl-1,3-thiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide

2389-2694 Screening compound: (2E)-N-(5-benzyl-1,3-thiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide
2389-2694 Screening compound: (2E)-N-(5-benzyl-1,3-thiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2389-2694
(2E)-N-(5-benzyl-1,3-thiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide

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

2389-2694

Molecular Formula

C20H18N2O2S (C20 H18 N2 O2 S)

Compound Name

(2E)-N-(5-benzyl-1,3-thiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide

IUPAC name

(2E)-N-(5-benzyl-13-thiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide

SMILES

COc1ccc(/C=C/C(Nc2ncc(Cc3ccccc3)s2)=O)cc1

InChI

InChI=1S/C20H18N2O2S/c1-24-17-10-7-15(8-11-17)9-12-19(23)22-20-21-14-18(25-20)13-16-5-3-2-4-6-16/h2-12,14H,13H2,1H3,(H,21,22,23)

InChI Key

JDXOTJCPQACAJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01816837

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.44

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

5.205

Distribution Coefficient, logD

5.203

Water Solubility, LogSw

-5.01

Polar Surface Area

40.957

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

2389-2694 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 2389-2694 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2389-2694?
Check Price and Availability of 2389-2694, 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 2389-2694 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2389-2694
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2389-2694
  • 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 2389-2694 available by request