8290-02872 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethylbenzamide

8290-02872 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethylbenzamide
8290-02872 Screening compound: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8290-02872
N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethylbenzamide

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

8290-02872

Molecular Formula

C23H20N2OS (C23 H20 N2 OS)

Compound Name

N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-ethylbenzamide

IUPAC name

N-[5-(13-benzothiazol-2-yl)-2-methylphenyl]-4-ethylbenzamide

SMILES

CCc(cc1)ccc1C(Nc1c(C)ccc(-c2nc(cccc3)c3s2)c1)=O

InChI

InChI=1S/C23H20N2OS/c1-3-16-9-12-17(13-10-16)22(26)24-20-14-18(11-8-15(20)2)23-25-19-6-4-5-7-21(19)27-23/h4-14H,3H2,1-2H3,(H,24,26)

InChI Key

IMZXZJLGBYBWPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08677807

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.237

Distribution Coefficient, logD

6.237

Water Solubility, LogSw

-5.46

Polar Surface Area

32.081

Acid Dissociation Constant (pKa)

11.37

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

8290-02872 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8290-02872 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8290-02872?
Check Price and Availability of 8290-02872, 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 8290-02872 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8290-02872
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8290-02872
  • 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 8290-02872 available by request