8290-02875 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-methoxy-3-methylbenzamide

8290-02875 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-methoxy-3-methylbenzamide
8290-02875 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-methoxy-3-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8290-02875
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-methoxy-3-methylbenzamide

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

8290-02875

Molecular Formula

C23H20N2O2S (C23 H20 N2 O2 S)

Compound Name

N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-methoxy-3-methylbenzamide

IUPAC name

N-[3-(13-benzothiazol-2-yl)-2-methylphenyl]-2-methoxy-3-methylbenzamide

SMILES

Cc1cccc(C(Nc2cccc(-c3nc(cccc4)c4s3)c2C)=O)c1OC

InChI

InChI=1S/C23H20N2O2S/c1-14-8-6-10-17(21(14)27-3)22(26)24-18-12-7-9-16(15(18)2)23-25-19-11-4-5-13-20(19)28-23/h4-13H,1-3H3,(H,24,26)

InChI Key

NZSSCGMNRBEXGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08712978

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.767

Distribution Coefficient, logD

5.765

Water Solubility, LogSw

-5.56

Polar Surface Area

39.798

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

-0.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

8290-02875 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8290-02875 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8290-02875?
Check Price and Availability of 8290-02875, 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 8290-02875 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8290-02875
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8290-02875
  • 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 8290-02875 available by request