E235-0389 Screening compound: N~7~-(2,4-dimethylphenyl)-2-(4-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide

E235-0389 Screening compound: N~7~-(2,4-dimethylphenyl)-2-(4-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide
E235-0389 Screening compound: N~7~-(2,4-dimethylphenyl)-2-(4-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E235-0389
N~7~-(2,4-dimethylphenyl)-2-(4-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide

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

E235-0389

Molecular Formula

C25H21N3O2S (C25 H21 N3 O2 S)

Compound Name

N~7~-(2,4-dimethylphenyl)-2-(4-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole-7-carboxamide

IUPAC name

N-(24-dimethylphenyl)-4-(4-methoxyphenyl)-7-thia-25-diazatricyclo[6.4.0.0^{26}]dodeca-1(12)35810-pentaene-10-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(c(cc1)cc(s2)c1n1c2nc(-c(cc2)ccc2OC)c1)=O

InChI

InChI=1S/C25H21N3O2S/c1-15-4-10-20(16(2)12-15)26-24(29)18-7-11-22-23(13-18)31-25-27-21(14-28(22)25)17-5-8-19(30-3)9-6-17/h4-14H,1-3H3,(H,26,29)

InChI Key

WVAVJKPKXMMCOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14851440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.046

Distribution Coefficient, logD

6.028

Water Solubility, LogSw

-5.31

Polar Surface Area

38.882

Acid Dissociation Constant (pKa)

11.14

Base Dissociation Constant (pKb)

6.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

E235-0389 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 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 E235-0389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E235-0389?
Check Price and Availability of E235-0389, 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 E235-0389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E235-0389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E235-0389
  • 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 E235-0389 available by request